Iron in PDB 4jx1: Crystal Structure of Reduced Cytochrome P450CAM-Putidaredoxin Complex Bound to Camphor and 5-Exo-Hydroxycamphor
Enzymatic activity of Crystal Structure of Reduced Cytochrome P450CAM-Putidaredoxin Complex Bound to Camphor and 5-Exo-Hydroxycamphor
All present enzymatic activity of Crystal Structure of Reduced Cytochrome P450CAM-Putidaredoxin Complex Bound to Camphor and 5-Exo-Hydroxycamphor:
1.14.15.1;
Protein crystallography data
The structure of Crystal Structure of Reduced Cytochrome P450CAM-Putidaredoxin Complex Bound to Camphor and 5-Exo-Hydroxycamphor, PDB code: 4jx1
was solved by
S.M.Tripathi,
H.Li,
T.L.Poulos,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
|
Resolution Low / High (Å)
|
44.87 /
2.09
|
|
Space group
|
P 1 21 1
|
|
Cell size a, b, c (Å), α, β, γ (°)
|
86.850,
108.960,
115.160,
90.00,
109.03,
90.00
|
|
R / Rfree (%)
|
14.4 /
21.2
|
Other elements in 4jx1:
The structure of Crystal Structure of Reduced Cytochrome P450CAM-Putidaredoxin Complex Bound to Camphor and 5-Exo-Hydroxycamphor also contains other interesting chemical elements:
Iron Binding Sites:
Pages:
>>> Page 1 <<<
Page 2, Binding sites: 11 -
12;
Binding sites:
The binding sites of Iron atom in the Crystal Structure of Reduced Cytochrome P450CAM-Putidaredoxin Complex Bound to Camphor and 5-Exo-Hydroxycamphor
(pdb code 4jx1). This binding sites where shown within
5.0 Angstroms radius around Iron atom.
In total 12 binding sites of Iron where determined in the
Crystal Structure of Reduced Cytochrome P450CAM-Putidaredoxin Complex Bound to Camphor and 5-Exo-Hydroxycamphor, PDB code: 4jx1:
Jump to Iron binding site number:
1;
2;
3;
4;
5;
6;
7;
8;
9;
10;
Iron binding site 1 out
of 12 in 4jx1
Go back to
Iron Binding Sites List in 4jx1
Iron binding site 1 out
of 12 in the Crystal Structure of Reduced Cytochrome P450CAM-Putidaredoxin Complex Bound to Camphor and 5-Exo-Hydroxycamphor
 Mono view
 Stereo pair view
|
|
A full contact list of Iron with other atoms in the Fe binding
site number 1 of Crystal Structure of Reduced Cytochrome P450CAM-Putidaredoxin Complex Bound to Camphor and 5-Exo-Hydroxycamphor within 5.0Å range:
|
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Fe501
b:11.7
occ:1.00
|
FE
|
A:HEM501
|
0.0
|
11.7
|
1.0
|
|
NB
|
A:HEM501
|
2.0
|
10.7
|
1.0
|
|
NC
|
A:HEM501
|
2.1
|
8.6
|
1.0
|
|
ND
|
A:HEM501
|
2.1
|
16.4
|
1.0
|
|
NA
|
A:HEM501
|
2.1
|
10.8
|
1.0
|
|
O
|
A:HOH687
|
2.1
|
20.3
|
1.0
|
|
SG
|
A:CYS357
|
2.3
|
10.6
|
1.0
|
|
C4B
|
A:HEM501
|
3.0
|
8.3
|
1.0
|
|
C1C
|
A:HEM501
|
3.0
|
8.5
|
1.0
|
|
C4D
|
A:HEM501
|
3.1
|
10.9
|
1.0
|
|
C1B
|
A:HEM501
|
3.1
|
13.3
|
1.0
|
|
HB2
|
A:CYS357
|
3.1
|
12.7
|
1.0
|
|
C4C
|
A:HEM501
|
3.1
|
7.7
|
1.0
|
|
C1A
|
A:HEM501
|
3.1
|
7.3
|
1.0
|
|
C1D
|
A:HEM501
|
3.1
|
12.3
|
1.0
|
|
C4A
|
A:HEM501
|
3.1
|
12.8
|
1.0
|
|
CB
|
A:CYS357
|
3.3
|
10.6
|
1.0
|
|
CHC
|
A:HEM501
|
3.4
|
11.8
|
1.0
|
|
CHA
|
A:HEM501
|
3.4
|
7.6
|
1.0
|
|
CHD
|
A:HEM501
|
3.5
|
7.0
|
1.0
|
|
CHB
|
A:HEM501
|
3.5
|
12.9
|
1.0
|
|
HA
|
A:CYS357
|
3.7
|
14.1
|
1.0
|
|
O5
|
A:CAH503
|
4.0
|
36.4
|
1.0
|
|
HB3
|
A:CYS357
|
4.1
|
12.7
|
1.0
|
|
H
|
A:GLY359
|
4.1
|
16.8
|
1.0
|
|
CA
|
A:CYS357
|
4.1
|
11.8
|
1.0
|
|
HO5
|
A:CAH503
|
4.1
|
43.6
|
1.0
|
|
H92
|
A:CAH503
|
4.1
|
34.3
|
1.0
|
|
O
|
A:GLY248
|
4.1
|
13.5
|
1.0
|
|
HG1
|
A:THR252
|
4.2
|
30.8
|
1.0
|
|
C3B
|
A:HEM501
|
4.2
|
11.6
|
1.0
|
|
C2B
|
A:HEM501
|
4.3
|
11.6
|
1.0
|
|
C2C
|
A:HEM501
|
4.3
|
8.4
|
1.0
|
|
C3C
|
A:HEM501
|
4.3
|
6.9
|
1.0
|
|
C3D
|
A:HEM501
|
4.3
|
14.3
|
1.0
|
|
C3A
|
A:HEM501
|
4.3
|
8.3
|
1.0
|
|
C2A
|
A:HEM501
|
4.3
|
9.3
|
1.0
|
|
HG21
|
A:THR252
|
4.3
|
23.9
|
1.0
|
|
C2D
|
A:HEM501
|
4.4
|
9.5
|
1.0
|
|
HHC
|
A:HEM501
|
4.4
|
14.2
|
1.0
|
|
HD1
|
A:PHE350
|
4.4
|
9.8
|
1.0
|
|
HHA
|
A:HEM501
|
4.4
|
9.1
|
1.0
|
|
HHB
|
A:HEM501
|
4.5
|
15.5
|
1.0
|
|
HHD
|
A:HEM501
|
4.5
|
8.4
|
1.0
|
|
HA3
|
A:GLY359
|
4.6
|
19.0
|
1.0
|
|
H
|
A:LEU358
|
4.7
|
13.7
|
1.0
|
|
C
|
A:CYS357
|
4.8
|
13.8
|
1.0
|
|
HA3
|
A:GLY248
|
4.9
|
10.6
|
1.0
|
|
N
|
A:GLY359
|
4.9
|
14.0
|
1.0
|
|
C
|
A:GLY248
|
4.9
|
18.8
|
1.0
|
|
N
|
A:LEU358
|
5.0
|
11.4
|
1.0
|
|
Iron binding site 2 out
of 12 in 4jx1
Go back to
Iron Binding Sites List in 4jx1
Iron binding site 2 out
of 12 in the Crystal Structure of Reduced Cytochrome P450CAM-Putidaredoxin Complex Bound to Camphor and 5-Exo-Hydroxycamphor
 Mono view
 Stereo pair view
|
|
A full contact list of Iron with other atoms in the Fe binding
site number 2 of Crystal Structure of Reduced Cytochrome P450CAM-Putidaredoxin Complex Bound to Camphor and 5-Exo-Hydroxycamphor within 5.0Å range:
|
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Fe501
b:14.3
occ:1.00
|
FE
|
B:HEM501
|
0.0
|
14.3
|
1.0
|
|
NC
|
B:HEM501
|
2.0
|
12.1
|
1.0
|
|
NA
|
B:HEM501
|
2.0
|
14.0
|
1.0
|
|
ND
|
B:HEM501
|
2.1
|
17.8
|
1.0
|
|
NB
|
B:HEM501
|
2.1
|
8.7
|
1.0
|
|
SG
|
B:CYS357
|
2.4
|
15.4
|
1.0
|
|
C4C
|
B:HEM501
|
3.0
|
8.5
|
1.0
|
|
C1A
|
B:HEM501
|
3.0
|
13.7
|
1.0
|
|
C1C
|
B:HEM501
|
3.0
|
12.1
|
1.0
|
|
C4A
|
B:HEM501
|
3.0
|
12.2
|
1.0
|
|
C4D
|
B:HEM501
|
3.1
|
15.4
|
1.0
|
|
C1B
|
B:HEM501
|
3.1
|
10.5
|
1.0
|
|
C1D
|
B:HEM501
|
3.1
|
18.0
|
1.0
|
|
C4B
|
B:HEM501
|
3.1
|
7.3
|
1.0
|
|
HB2
|
B:CYS357
|
3.2
|
20.7
|
1.0
|
|
CHA
|
B:HEM501
|
3.4
|
15.5
|
1.0
|
|
CB
|
B:CYS357
|
3.4
|
17.2
|
1.0
|
|
CHD
|
B:HEM501
|
3.4
|
11.3
|
1.0
|
|
CHB
|
B:HEM501
|
3.4
|
15.5
|
1.0
|
|
CHC
|
B:HEM501
|
3.5
|
16.0
|
1.0
|
|
HA
|
B:CYS357
|
3.7
|
21.8
|
1.0
|
|
H51
|
B:CAM502
|
3.8
|
50.4
|
1.0
|
|
H
|
B:GLY359
|
4.1
|
16.2
|
1.0
|
|
CA
|
B:CYS357
|
4.1
|
18.2
|
1.0
|
|
HG1
|
B:THR252
|
4.2
|
29.2
|
1.0
|
|
HB3
|
B:CYS357
|
4.2
|
20.7
|
1.0
|
|
O
|
B:GLY248
|
4.2
|
14.2
|
1.0
|
|
C2C
|
B:HEM501
|
4.2
|
8.0
|
1.0
|
|
H92
|
B:CAM502
|
4.2
|
39.1
|
1.0
|
|
C3C
|
B:HEM501
|
4.2
|
13.1
|
1.0
|
|
C3A
|
B:HEM501
|
4.2
|
17.3
|
1.0
|
|
C2A
|
B:HEM501
|
4.3
|
15.6
|
1.0
|
|
C3D
|
B:HEM501
|
4.3
|
13.1
|
1.0
|
|
C2B
|
B:HEM501
|
4.3
|
16.7
|
1.0
|
|
C3B
|
B:HEM501
|
4.3
|
12.5
|
1.0
|
|
C2D
|
B:HEM501
|
4.4
|
14.6
|
1.0
|
|
HHA
|
B:HEM501
|
4.4
|
18.6
|
1.0
|
|
HG21
|
B:THR252
|
4.4
|
25.1
|
1.0
|
|
HD1
|
B:PHE350
|
4.4
|
14.7
|
1.0
|
|
HHD
|
B:HEM501
|
4.4
|
13.5
|
1.0
|
|
HHB
|
B:HEM501
|
4.4
|
18.6
|
1.0
|
|
HHC
|
B:HEM501
|
4.4
|
19.2
|
1.0
|
|
HA3
|
B:GLY359
|
4.7
|
22.3
|
1.0
|
|
H
|
B:LEU358
|
4.7
|
19.5
|
1.0
|
|
C5
|
B:CAM502
|
4.7
|
42.0
|
1.0
|
|
HA3
|
B:GLY248
|
4.8
|
21.3
|
1.0
|
|
H91
|
B:CAM502
|
4.8
|
39.1
|
1.0
|
|
N
|
B:GLY359
|
4.9
|
13.5
|
1.0
|
|
H61
|
B:CAM502
|
4.9
|
65.0
|
1.0
|
|
C
|
B:CYS357
|
4.9
|
12.0
|
1.0
|
|
C
|
B:GLY248
|
4.9
|
24.8
|
1.0
|
|
C9
|
B:CAM502
|
5.0
|
32.5
|
1.0
|
|
Iron binding site 3 out
of 12 in 4jx1
Go back to
Iron Binding Sites List in 4jx1
Iron binding site 3 out
of 12 in the Crystal Structure of Reduced Cytochrome P450CAM-Putidaredoxin Complex Bound to Camphor and 5-Exo-Hydroxycamphor
 Mono view
 Stereo pair view
|
|
A full contact list of Iron with other atoms in the Fe binding
site number 3 of Crystal Structure of Reduced Cytochrome P450CAM-Putidaredoxin Complex Bound to Camphor and 5-Exo-Hydroxycamphor within 5.0Å range:
|
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Fe201
b:12.4
occ:1.00
|
FE1
|
C:FES201
|
0.0
|
12.4
|
1.0
|
|
S1
|
C:FES201
|
2.2
|
10.9
|
1.0
|
|
S2
|
C:FES201
|
2.2
|
10.7
|
1.0
|
|
SG
|
C:CYS39
|
2.3
|
13.0
|
1.0
|
|
SG
|
C:CYS45
|
2.4
|
11.8
|
1.0
|
|
FE2
|
C:FES201
|
2.7
|
11.8
|
1.0
|
|
H
|
C:CYS45
|
2.8
|
13.3
|
1.0
|
|
H
|
C:CYS39
|
3.0
|
12.0
|
1.0
|
|
HB3
|
C:CYS39
|
3.2
|
16.9
|
1.0
|
|
H
|
C:SER44
|
3.3
|
14.4
|
1.0
|
|
CB
|
C:CYS39
|
3.4
|
14.1
|
1.0
|
|
H
|
C:GLY41
|
3.4
|
18.9
|
1.0
|
|
N
|
C:CYS45
|
3.5
|
11.1
|
1.0
|
|
H
|
C:ALA46
|
3.6
|
26.1
|
1.0
|
|
CB
|
C:CYS45
|
3.7
|
10.5
|
1.0
|
|
H
|
C:THR47
|
3.7
|
12.9
|
1.0
|
|
N
|
C:CYS39
|
3.8
|
10.0
|
1.0
|
|
HB3
|
C:CYS45
|
3.8
|
12.6
|
1.0
|
|
HG1
|
C:THR47
|
3.9
|
12.7
|
1.0
|
|
H
|
C:ALA43
|
4.0
|
15.5
|
1.0
|
|
CA
|
C:CYS45
|
4.0
|
10.9
|
1.0
|
|
CA
|
C:CYS39
|
4.0
|
14.6
|
1.0
|
|
H
|
C:SER42
|
4.1
|
16.4
|
1.0
|
|
N
|
C:SER44
|
4.1
|
12.0
|
1.0
|
|
N
|
C:ALA46
|
4.1
|
21.8
|
1.0
|
|
HA2
|
C:GLY41
|
4.1
|
19.1
|
1.0
|
|
H
|
C:GLY40
|
4.1
|
17.0
|
1.0
|
|
HA2
|
C:GLY37
|
4.1
|
23.9
|
1.0
|
|
HB2
|
C:CYS39
|
4.2
|
16.9
|
1.0
|
|
N
|
C:GLY41
|
4.2
|
15.7
|
1.0
|
|
HA
|
C:ALA43
|
4.3
|
13.6
|
1.0
|
|
HB3
|
C:CYS48
|
4.4
|
19.8
|
1.0
|
|
C
|
C:CYS45
|
4.4
|
19.3
|
1.0
|
|
N
|
C:GLY40
|
4.5
|
14.2
|
1.0
|
|
C
|
C:SER44
|
4.5
|
15.5
|
1.0
|
|
C
|
C:CYS39
|
4.5
|
18.5
|
1.0
|
|
SG
|
C:CYS86
|
4.5
|
11.9
|
1.0
|
|
N
|
C:ALA43
|
4.5
|
12.9
|
1.0
|
|
HB2
|
C:CYS45
|
4.5
|
12.6
|
1.0
|
|
H
|
C:ASP38
|
4.5
|
18.6
|
1.0
|
|
N
|
C:THR47
|
4.6
|
10.7
|
1.0
|
|
CA
|
C:GLY41
|
4.6
|
16.0
|
1.0
|
|
N
|
C:ASP38
|
4.6
|
15.5
|
1.0
|
|
HB2
|
C:SER44
|
4.6
|
13.6
|
1.0
|
|
N
|
C:SER42
|
4.6
|
13.7
|
1.0
|
|
C
|
C:GLY37
|
4.7
|
17.9
|
1.0
|
|
OG1
|
C:THR47
|
4.7
|
10.6
|
1.0
|
|
SG
|
C:CYS48
|
4.7
|
13.8
|
1.0
|
|
CA
|
C:SER44
|
4.8
|
11.2
|
1.0
|
|
CA
|
C:ALA43
|
4.8
|
11.4
|
1.0
|
|
CA
|
C:GLY37
|
4.9
|
19.9
|
1.0
|
|
HE2
|
C:MET24
|
4.9
|
17.4
|
1.0
|
|
HB3
|
C:CYS86
|
4.9
|
12.7
|
1.0
|
|
HA
|
C:CYS45
|
4.9
|
13.1
|
1.0
|
|
C
|
C:ASP38
|
4.9
|
10.3
|
1.0
|
|
HA
|
C:CYS39
|
4.9
|
17.6
|
1.0
|
|
C
|
C:ALA43
|
4.9
|
16.1
|
1.0
|
|
HB3
|
C:ASP38
|
5.0
|
13.0
|
1.0
|
|
H
|
C:CYS48
|
5.0
|
17.6
|
1.0
|
|
Iron binding site 4 out
of 12 in 4jx1
Go back to
Iron Binding Sites List in 4jx1
Iron binding site 4 out
of 12 in the Crystal Structure of Reduced Cytochrome P450CAM-Putidaredoxin Complex Bound to Camphor and 5-Exo-Hydroxycamphor
 Mono view
 Stereo pair view
|
|
A full contact list of Iron with other atoms in the Fe binding
site number 4 of Crystal Structure of Reduced Cytochrome P450CAM-Putidaredoxin Complex Bound to Camphor and 5-Exo-Hydroxycamphor within 5.0Å range:
|
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Fe201
b:11.8
occ:1.00
|
FE2
|
C:FES201
|
0.0
|
11.8
|
1.0
|
|
S2
|
C:FES201
|
2.2
|
10.7
|
1.0
|
|
S1
|
C:FES201
|
2.2
|
10.9
|
1.0
|
|
SG
|
C:CYS86
|
2.4
|
11.9
|
1.0
|
|
SG
|
C:CYS48
|
2.4
|
13.8
|
1.0
|
|
FE1
|
C:FES201
|
2.7
|
12.4
|
1.0
|
|
HB3
|
C:CYS86
|
2.9
|
12.7
|
1.0
|
|
HB3
|
C:CYS48
|
3.1
|
19.8
|
1.0
|
|
CB
|
C:CYS86
|
3.2
|
10.6
|
1.0
|
|
CB
|
C:CYS48
|
3.3
|
16.5
|
1.0
|
|
HB3
|
C:LEU84
|
3.4
|
19.8
|
1.0
|
|
HA2
|
C:GLY41
|
3.5
|
19.1
|
1.0
|
|
H
|
C:CYS86
|
3.6
|
20.6
|
1.0
|
|
H
|
C:ALA43
|
3.8
|
15.5
|
1.0
|
|
HB2
|
C:CYS86
|
3.8
|
12.7
|
1.0
|
|
HB2
|
C:CYS48
|
3.9
|
19.8
|
1.0
|
|
HA
|
C:ALA43
|
4.0
|
13.6
|
1.0
|
|
HD13
|
C:LEU84
|
4.0
|
15.6
|
1.0
|
|
HD23
|
C:LEU84
|
4.1
|
23.6
|
1.0
|
|
H
|
C:CYS48
|
4.1
|
17.6
|
1.0
|
|
HG3
|
C:MET24
|
4.1
|
12.9
|
1.0
|
|
N
|
C:CYS86
|
4.3
|
17.2
|
1.0
|
|
CB
|
C:LEU84
|
4.3
|
16.5
|
1.0
|
|
HA2
|
C:GLY37
|
4.3
|
23.9
|
1.0
|
|
CA
|
C:CYS86
|
4.3
|
11.1
|
1.0
|
|
H
|
C:GLY41
|
4.4
|
18.9
|
1.0
|
|
H
|
C:ALA46
|
4.4
|
26.1
|
1.0
|
|
CA
|
C:GLY41
|
4.4
|
16.0
|
1.0
|
|
N
|
C:CYS48
|
4.4
|
14.7
|
1.0
|
|
HE2
|
C:MET24
|
4.5
|
17.4
|
1.0
|
|
SG
|
C:CYS39
|
4.5
|
13.0
|
1.0
|
|
CA
|
C:CYS48
|
4.5
|
11.9
|
1.0
|
|
H
|
C:THR47
|
4.5
|
12.9
|
1.0
|
|
N
|
C:ALA43
|
4.5
|
12.9
|
1.0
|
|
H
|
C:CYS45
|
4.6
|
13.3
|
1.0
|
|
SG
|
C:CYS45
|
4.7
|
11.8
|
1.0
|
|
HB2
|
C:MET24
|
4.7
|
13.1
|
1.0
|
|
H
|
C:SER44
|
4.7
|
14.4
|
1.0
|
|
CA
|
C:ALA43
|
4.7
|
11.4
|
1.0
|
|
HE21
|
C:GLN87
|
4.7
|
20.9
|
1.0
|
|
HB2
|
C:LEU84
|
4.7
|
19.8
|
1.0
|
|
HA
|
C:ALA46
|
4.8
|
20.4
|
1.0
|
|
N
|
C:GLY41
|
4.8
|
15.7
|
1.0
|
|
CD1
|
C:LEU84
|
4.8
|
13.0
|
1.0
|
|
HG2
|
C:GLN87
|
4.9
|
24.5
|
1.0
|
|
CD2
|
C:LEU84
|
4.9
|
19.7
|
1.0
|
|
C
|
C:GLY41
|
4.9
|
14.8
|
1.0
|
|
CG
|
C:LEU84
|
4.9
|
12.7
|
1.0
|
|
H
|
C:SER42
|
4.9
|
16.4
|
1.0
|
|
N
|
C:ALA46
|
5.0
|
21.8
|
1.0
|
|
HA
|
C:CYS86
|
5.0
|
13.3
|
1.0
|
|
CG
|
C:MET24
|
5.0
|
10.8
|
1.0
|
|
Iron binding site 5 out
of 12 in 4jx1
Go back to
Iron Binding Sites List in 4jx1
Iron binding site 5 out
of 12 in the Crystal Structure of Reduced Cytochrome P450CAM-Putidaredoxin Complex Bound to Camphor and 5-Exo-Hydroxycamphor
 Mono view
 Stereo pair view
|
|
A full contact list of Iron with other atoms in the Fe binding
site number 5 of Crystal Structure of Reduced Cytochrome P450CAM-Putidaredoxin Complex Bound to Camphor and 5-Exo-Hydroxycamphor within 5.0Å range:
|
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:Fe201
b:16.9
occ:1.00
|
FE1
|
D:FES201
|
0.0
|
16.9
|
1.0
|
|
S2
|
D:FES201
|
2.2
|
16.6
|
1.0
|
|
S1
|
D:FES201
|
2.2
|
19.4
|
1.0
|
|
SG
|
D:CYS39
|
2.2
|
14.0
|
1.0
|
|
SG
|
D:CYS45
|
2.4
|
18.4
|
1.0
|
|
FE2
|
D:FES201
|
2.8
|
17.7
|
1.0
|
|
H
|
D:CYS39
|
2.9
|
26.1
|
1.0
|
|
H
|
D:CYS45
|
3.0
|
18.2
|
1.0
|
|
H
|
D:SER44
|
3.3
|
19.6
|
1.0
|
|
HB3
|
D:CYS39
|
3.3
|
20.9
|
1.0
|
|
CB
|
D:CYS39
|
3.4
|
17.4
|
1.0
|
|
H
|
D:ALA46
|
3.5
|
18.9
|
1.0
|
|
H
|
D:GLY41
|
3.5
|
16.7
|
1.0
|
|
CB
|
D:CYS45
|
3.6
|
14.4
|
1.0
|
|
HB3
|
D:CYS45
|
3.6
|
17.3
|
1.0
|
|
N
|
D:CYS45
|
3.6
|
15.2
|
1.0
|
|
N
|
D:CYS39
|
3.7
|
21.8
|
1.0
|
|
H
|
D:THR47
|
3.7
|
25.3
|
1.0
|
|
HG1
|
D:THR47
|
3.8
|
17.8
|
1.0
|
|
N
|
D:ALA46
|
4.0
|
15.8
|
1.0
|
|
CA
|
D:CYS39
|
4.0
|
21.3
|
1.0
|
|
CA
|
D:CYS45
|
4.0
|
18.3
|
1.0
|
|
H
|
D:GLY40
|
4.1
|
23.6
|
1.0
|
|
N
|
D:SER44
|
4.1
|
16.3
|
1.0
|
|
HA2
|
D:GLY37
|
4.1
|
18.1
|
1.0
|
|
H
|
D:ALA43
|
4.1
|
21.3
|
1.0
|
|
HA2
|
D:GLY41
|
4.2
|
22.2
|
1.0
|
|
HB2
|
D:CYS39
|
4.2
|
20.9
|
1.0
|
|
H
|
D:SER42
|
4.2
|
21.5
|
1.0
|
|
N
|
D:GLY41
|
4.3
|
13.9
|
1.0
|
|
HA
|
D:ALA43
|
4.3
|
23.7
|
1.0
|
|
H
|
D:ASP38
|
4.3
|
17.2
|
1.0
|
|
HB2
|
D:CYS45
|
4.4
|
17.3
|
1.0
|
|
C
|
D:CYS45
|
4.4
|
17.8
|
1.0
|
|
N
|
D:GLY40
|
4.4
|
19.7
|
1.0
|
|
N
|
D:ASP38
|
4.5
|
14.3
|
1.0
|
|
HB2
|
D:SER44
|
4.5
|
27.4
|
1.0
|
|
HB3
|
D:CYS48
|
4.5
|
18.5
|
1.0
|
|
C
|
D:CYS39
|
4.5
|
18.4
|
1.0
|
|
SG
|
D:CYS86
|
4.5
|
20.7
|
1.0
|
|
N
|
D:THR47
|
4.5
|
21.1
|
1.0
|
|
OG1
|
D:THR47
|
4.6
|
14.8
|
1.0
|
|
N
|
D:ALA43
|
4.6
|
17.8
|
1.0
|
|
C
|
D:SER44
|
4.6
|
16.1
|
1.0
|
|
C
|
D:GLY37
|
4.6
|
13.0
|
1.0
|
|
CA
|
D:GLY41
|
4.7
|
18.5
|
1.0
|
|
N
|
D:SER42
|
4.7
|
17.9
|
1.0
|
|
SG
|
D:CYS48
|
4.8
|
17.3
|
1.0
|
|
CA
|
D:ALA43
|
4.8
|
19.7
|
1.0
|
|
CA
|
D:SER44
|
4.8
|
15.9
|
1.0
|
|
C
|
D:ASP38
|
4.8
|
16.8
|
1.0
|
|
CA
|
D:GLY37
|
4.9
|
15.1
|
1.0
|
|
HA
|
D:ALA46
|
4.9
|
20.3
|
1.0
|
|
HE2
|
D:MET24
|
4.9
|
17.6
|
1.0
|
|
H
|
D:CYS48
|
4.9
|
16.9
|
1.0
|
|
HA
|
D:CYS39
|
4.9
|
25.6
|
1.0
|
|
HA
|
D:CYS45
|
4.9
|
22.0
|
1.0
|
|
C
|
D:ALA43
|
4.9
|
18.1
|
1.0
|
|
HB3
|
D:CYS86
|
5.0
|
16.9
|
1.0
|
|
HB3
|
D:ASP38
|
5.0
|
25.7
|
1.0
|
|
CA
|
D:ALA46
|
5.0
|
16.9
|
1.0
|
|
Iron binding site 6 out
of 12 in 4jx1
Go back to
Iron Binding Sites List in 4jx1
Iron binding site 6 out
of 12 in the Crystal Structure of Reduced Cytochrome P450CAM-Putidaredoxin Complex Bound to Camphor and 5-Exo-Hydroxycamphor
 Mono view
 Stereo pair view
|
|
A full contact list of Iron with other atoms in the Fe binding
site number 6 of Crystal Structure of Reduced Cytochrome P450CAM-Putidaredoxin Complex Bound to Camphor and 5-Exo-Hydroxycamphor within 5.0Å range:
|
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:Fe201
b:17.7
occ:1.00
|
FE2
|
D:FES201
|
0.0
|
17.7
|
1.0
|
|
S2
|
D:FES201
|
2.2
|
16.6
|
1.0
|
|
S1
|
D:FES201
|
2.2
|
19.4
|
1.0
|
|
SG
|
D:CYS48
|
2.3
|
17.3
|
1.0
|
|
SG
|
D:CYS86
|
2.3
|
20.7
|
1.0
|
|
HB3
|
D:CYS86
|
2.8
|
16.9
|
1.0
|
|
FE1
|
D:FES201
|
2.8
|
16.9
|
1.0
|
|
HB3
|
D:CYS48
|
3.1
|
18.5
|
1.0
|
|
CB
|
D:CYS86
|
3.1
|
14.1
|
1.0
|
|
CB
|
D:CYS48
|
3.3
|
15.4
|
1.0
|
|
HB3
|
D:LEU84
|
3.4
|
24.8
|
1.0
|
|
HA2
|
D:GLY41
|
3.5
|
22.2
|
1.0
|
|
H
|
D:CYS86
|
3.6
|
22.3
|
1.0
|
|
HB2
|
D:CYS86
|
3.7
|
16.9
|
1.0
|
|
H
|
D:ALA43
|
3.8
|
21.3
|
1.0
|
|
HB2
|
D:CYS48
|
3.9
|
18.5
|
1.0
|
|
HA
|
D:ALA43
|
3.9
|
23.7
|
1.0
|
|
H
|
D:CYS48
|
3.9
|
16.9
|
1.0
|
|
HD13
|
D:LEU84
|
3.9
|
30.3
|
1.0
|
|
HG3
|
D:MET24
|
4.0
|
22.4
|
1.0
|
|
HD22
|
D:LEU84
|
4.1
|
31.5
|
1.0
|
|
HA2
|
D:GLY37
|
4.3
|
18.1
|
1.0
|
|
N
|
D:CYS86
|
4.3
|
18.6
|
1.0
|
|
CA
|
D:CYS86
|
4.3
|
19.6
|
1.0
|
|
H
|
D:ALA46
|
4.3
|
18.9
|
1.0
|
|
N
|
D:CYS48
|
4.4
|
14.1
|
1.0
|
|
CB
|
D:LEU84
|
4.4
|
20.7
|
1.0
|
|
CA
|
D:GLY41
|
4.4
|
18.5
|
1.0
|
|
H
|
D:GLY41
|
4.4
|
16.7
|
1.0
|
|
H
|
D:THR47
|
4.4
|
25.3
|
1.0
|
|
SG
|
D:CYS39
|
4.5
|
14.0
|
1.0
|
|
CA
|
D:CYS48
|
4.5
|
19.3
|
1.0
|
|
HE2
|
D:MET24
|
4.5
|
17.6
|
1.0
|
|
N
|
D:ALA43
|
4.6
|
17.8
|
1.0
|
|
SG
|
D:CYS45
|
4.6
|
18.4
|
1.0
|
|
HA
|
D:ALA46
|
4.6
|
20.3
|
1.0
|
|
CA
|
D:ALA43
|
4.7
|
19.7
|
1.0
|
|
HB2
|
D:MET24
|
4.7
|
16.2
|
1.0
|
|
H
|
D:SER44
|
4.7
|
19.6
|
1.0
|
|
H
|
D:CYS45
|
4.8
|
18.2
|
1.0
|
|
CD1
|
D:LEU84
|
4.8
|
25.2
|
1.0
|
|
N
|
D:GLY41
|
4.8
|
13.9
|
1.0
|
|
HE21
|
D:GLN87
|
4.8
|
23.1
|
1.0
|
|
HB2
|
D:LEU84
|
4.8
|
24.8
|
1.0
|
|
HG2
|
D:GLN87
|
4.9
|
29.9
|
1.0
|
|
CD2
|
D:LEU84
|
4.9
|
26.2
|
1.0
|
|
C
|
D:GLY41
|
4.9
|
19.6
|
1.0
|
|
CG
|
D:MET24
|
4.9
|
18.6
|
1.0
|
|
CG
|
D:LEU84
|
4.9
|
29.1
|
1.0
|
|
HA
|
D:LEU84
|
5.0
|
23.8
|
1.0
|
|
N
|
D:ALA46
|
5.0
|
15.8
|
1.0
|
|
N
|
D:THR47
|
5.0
|
21.1
|
1.0
|
|
HA
|
D:CYS86
|
5.0
|
23.6
|
1.0
|
|
Iron binding site 7 out
of 12 in 4jx1
Go back to
Iron Binding Sites List in 4jx1
Iron binding site 7 out
of 12 in the Crystal Structure of Reduced Cytochrome P450CAM-Putidaredoxin Complex Bound to Camphor and 5-Exo-Hydroxycamphor
 Mono view
 Stereo pair view
|
|
A full contact list of Iron with other atoms in the Fe binding
site number 7 of Crystal Structure of Reduced Cytochrome P450CAM-Putidaredoxin Complex Bound to Camphor and 5-Exo-Hydroxycamphor within 5.0Å range:
|
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
E:Fe501
b:12.2
occ:1.00
|
FE
|
E:HEM501
|
0.0
|
12.2
|
1.0
|
|
NB
|
E:HEM501
|
2.0
|
8.6
|
1.0
|
|
ND
|
E:HEM501
|
2.1
|
10.9
|
1.0
|
|
O
|
E:HOH601
|
2.1
|
26.1
|
1.0
|
|
NA
|
E:HEM501
|
2.1
|
9.4
|
1.0
|
|
NC
|
E:HEM501
|
2.1
|
9.2
|
1.0
|
|
SG
|
E:CYS357
|
2.3
|
16.1
|
1.0
|
|
C4B
|
E:HEM501
|
3.0
|
12.3
|
1.0
|
|
C1B
|
E:HEM501
|
3.0
|
10.8
|
1.0
|
|
C1C
|
E:HEM501
|
3.1
|
13.9
|
1.0
|
|
C4D
|
E:HEM501
|
3.1
|
14.8
|
1.0
|
|
C1D
|
E:HEM501
|
3.1
|
16.6
|
1.0
|
|
C4A
|
E:HEM501
|
3.1
|
14.4
|
1.0
|
|
C1A
|
E:HEM501
|
3.1
|
10.1
|
1.0
|
|
C4C
|
E:HEM501
|
3.1
|
14.1
|
1.0
|
|
HB2
|
E:CYS357
|
3.2
|
11.6
|
1.0
|
|
CB
|
E:CYS357
|
3.4
|
9.7
|
1.0
|
|
CHC
|
E:HEM501
|
3.4
|
10.1
|
1.0
|
|
CHB
|
E:HEM501
|
3.4
|
14.8
|
1.0
|
|
CHA
|
E:HEM501
|
3.4
|
7.3
|
1.0
|
|
CHD
|
E:HEM501
|
3.4
|
16.6
|
1.0
|
|
HA
|
E:CYS357
|
3.6
|
10.8
|
1.0
|
|
O5
|
E:CAH503
|
3.7
|
48.2
|
1.0
|
|
HO5
|
E:CAH503
|
3.8
|
57.9
|
1.0
|
|
H
|
E:GLY359
|
4.0
|
15.3
|
1.0
|
|
CA
|
E:CYS357
|
4.1
|
9.0
|
1.0
|
|
HB3
|
E:CYS357
|
4.1
|
11.6
|
1.0
|
|
O
|
E:GLY248
|
4.2
|
18.8
|
1.0
|
|
C3B
|
E:HEM501
|
4.3
|
11.4
|
1.0
|
|
C2B
|
E:HEM501
|
4.3
|
15.5
|
1.0
|
|
C2C
|
E:HEM501
|
4.3
|
9.6
|
1.0
|
|
C3D
|
E:HEM501
|
4.3
|
17.4
|
1.0
|
|
C3A
|
E:HEM501
|
4.3
|
10.1
|
1.0
|
|
C2D
|
E:HEM501
|
4.3
|
16.5
|
1.0
|
|
H92
|
E:CAH503
|
4.3
|
33.2
|
1.0
|
|
C3C
|
E:HEM501
|
4.3
|
9.2
|
1.0
|
|
HG1
|
E:THR252
|
4.3
|
22.1
|
1.0
|
|
C2A
|
E:HEM501
|
4.3
|
11.5
|
1.0
|
|
HHC
|
E:HEM501
|
4.4
|
12.1
|
1.0
|
|
HG21
|
E:THR252
|
4.4
|
25.2
|
1.0
|
|
HHA
|
E:HEM501
|
4.4
|
8.8
|
1.0
|
|
HHB
|
E:HEM501
|
4.4
|
17.8
|
1.0
|
|
HD1
|
E:PHE350
|
4.4
|
11.3
|
1.0
|
|
HHD
|
E:HEM501
|
4.4
|
19.9
|
1.0
|
|
HA3
|
E:GLY359
|
4.6
|
15.1
|
1.0
|
|
H62
|
E:CAH503
|
4.6
|
52.4
|
1.0
|
|
H
|
E:LEU358
|
4.7
|
12.3
|
1.0
|
|
HA3
|
E:GLY248
|
4.8
|
17.7
|
1.0
|
|
N
|
E:GLY359
|
4.8
|
12.8
|
1.0
|
|
C
|
E:CYS357
|
4.8
|
15.0
|
1.0
|
|
C
|
E:GLY248
|
4.9
|
15.5
|
1.0
|
|
C5
|
E:CAH503
|
4.9
|
40.4
|
1.0
|
|
N
|
E:LEU358
|
5.0
|
10.2
|
1.0
|
|
Iron binding site 8 out
of 12 in 4jx1
Go back to
Iron Binding Sites List in 4jx1
Iron binding site 8 out
of 12 in the Crystal Structure of Reduced Cytochrome P450CAM-Putidaredoxin Complex Bound to Camphor and 5-Exo-Hydroxycamphor
 Mono view
 Stereo pair view
|
|
A full contact list of Iron with other atoms in the Fe binding
site number 8 of Crystal Structure of Reduced Cytochrome P450CAM-Putidaredoxin Complex Bound to Camphor and 5-Exo-Hydroxycamphor within 5.0Å range:
|
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
F:Fe501
b:12.6
occ:1.00
|
FE
|
F:HEM501
|
0.0
|
12.6
|
1.0
|
|
NB
|
F:HEM501
|
2.0
|
13.3
|
1.0
|
|
NC
|
F:HEM501
|
2.0
|
11.3
|
1.0
|
|
ND
|
F:HEM501
|
2.1
|
11.0
|
1.0
|
|
NA
|
F:HEM501
|
2.1
|
12.3
|
1.0
|
|
SG
|
F:CYS357
|
2.3
|
12.6
|
1.0
|
|
O
|
F:HOH643
|
2.3
|
31.9
|
1.0
|
|
C1B
|
F:HEM501
|
3.0
|
16.2
|
1.0
|
|
C4C
|
F:HEM501
|
3.0
|
18.8
|
1.0
|
|
C1C
|
F:HEM501
|
3.1
|
15.0
|
1.0
|
|
C4A
|
F:HEM501
|
3.1
|
12.2
|
1.0
|
|
C1D
|
F:HEM501
|
3.1
|
6.4
|
1.0
|
|
C4D
|
F:HEM501
|
3.1
|
9.8
|
1.0
|
|
C4B
|
F:HEM501
|
3.1
|
11.6
|
1.0
|
|
HB2
|
F:CYS357
|
3.1
|
22.1
|
1.0
|
|
C1A
|
F:HEM501
|
3.1
|
8.7
|
1.0
|
|
CB
|
F:CYS357
|
3.3
|
18.4
|
1.0
|
|
CHB
|
F:HEM501
|
3.4
|
16.9
|
1.0
|
|
CHD
|
F:HEM501
|
3.4
|
14.5
|
1.0
|
|
CHC
|
F:HEM501
|
3.5
|
14.1
|
1.0
|
|
CHA
|
F:HEM501
|
3.5
|
10.0
|
1.0
|
|
HA
|
F:CYS357
|
3.7
|
11.5
|
1.0
|
|
H93
|
F:CAH503
|
3.8
|
43.5
|
1.0
|
|
H
|
F:GLY359
|
4.0
|
18.5
|
1.0
|
|
O
|
F:GLY248
|
4.0
|
14.4
|
1.0
|
|
HB3
|
F:CYS357
|
4.1
|
22.1
|
1.0
|
|
CA
|
F:CYS357
|
4.1
|
9.6
|
1.0
|
|
HG21
|
F:THR252
|
4.1
|
24.8
|
1.0
|
|
O5
|
F:CAH503
|
4.2
|
32.9
|
1.0
|
|
C2C
|
F:HEM501
|
4.2
|
16.1
|
1.0
|
|
C3C
|
F:HEM501
|
4.3
|
15.2
|
1.0
|
|
C2B
|
F:HEM501
|
4.3
|
16.9
|
1.0
|
|
C3A
|
F:HEM501
|
4.3
|
12.8
|
1.0
|
|
C3B
|
F:HEM501
|
4.3
|
7.5
|
1.0
|
|
HO5
|
F:CAH503
|
4.3
|
39.5
|
1.0
|
|
C3D
|
F:HEM501
|
4.3
|
12.2
|
1.0
|
|
HD1
|
F:PHE350
|
4.3
|
12.9
|
1.0
|
|
C2D
|
F:HEM501
|
4.3
|
11.3
|
1.0
|
|
C2A
|
F:HEM501
|
4.3
|
12.0
|
1.0
|
|
HHB
|
F:HEM501
|
4.4
|
20.2
|
1.0
|
|
HHD
|
F:HEM501
|
4.4
|
17.4
|
1.0
|
|
HHA
|
F:HEM501
|
4.4
|
12.0
|
1.0
|
|
HHC
|
F:HEM501
|
4.4
|
16.9
|
1.0
|
|
HG1
|
F:THR252
|
4.5
|
22.6
|
1.0
|
|
H92
|
F:CAH503
|
4.5
|
43.5
|
1.0
|
|
HA3
|
F:GLY359
|
4.6
|
16.8
|
1.0
|
|
C9
|
F:CAH503
|
4.6
|
36.3
|
1.0
|
|
H
|
F:LEU358
|
4.8
|
12.0
|
1.0
|
|
N
|
F:GLY359
|
4.8
|
15.4
|
1.0
|
|
C
|
F:CYS357
|
4.9
|
9.8
|
1.0
|
|
C
|
F:GLY248
|
4.9
|
21.1
|
1.0
|
|
HA3
|
F:GLY248
|
4.9
|
26.3
|
1.0
|
|
Iron binding site 9 out
of 12 in 4jx1
Go back to
Iron Binding Sites List in 4jx1
Iron binding site 9 out
of 12 in the Crystal Structure of Reduced Cytochrome P450CAM-Putidaredoxin Complex Bound to Camphor and 5-Exo-Hydroxycamphor
 Mono view
 Stereo pair view
|
|
A full contact list of Iron with other atoms in the Fe binding
site number 9 of Crystal Structure of Reduced Cytochrome P450CAM-Putidaredoxin Complex Bound to Camphor and 5-Exo-Hydroxycamphor within 5.0Å range:
|
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
G:Fe201
b:13.4
occ:1.00
|
FE1
|
G:FES201
|
0.0
|
13.4
|
1.0
|
|
S2
|
G:FES201
|
2.2
|
18.1
|
1.0
|
|
S1
|
G:FES201
|
2.2
|
17.3
|
1.0
|
|
SG
|
G:CYS39
|
2.3
|
14.3
|
1.0
|
|
SG
|
G:CYS45
|
2.4
|
13.8
|
1.0
|
|
FE2
|
G:FES201
|
2.8
|
14.3
|
1.0
|
|
H
|
G:CYS39
|
2.9
|
16.0
|
1.0
|
|
H
|
G:CYS45
|
3.1
|
19.5
|
1.0
|
|
H
|
G:SER44
|
3.2
|
16.6
|
1.0
|
|
HB3
|
G:CYS39
|
3.3
|
16.8
|
1.0
|
|
CB
|
G:CYS39
|
3.4
|
14.0
|
1.0
|
|
H
|
G:GLY41
|
3.4
|
20.9
|
1.0
|
|
H
|
G:ALA46
|
3.5
|
15.7
|
1.0
|
|
N
|
G:CYS39
|
3.6
|
13.4
|
1.0
|
|
CB
|
G:CYS45
|
3.6
|
13.3
|
1.0
|
|
N
|
G:CYS45
|
3.7
|
16.2
|
1.0
|
|
HB3
|
G:CYS45
|
3.7
|
16.0
|
1.0
|
|
H
|
G:THR47
|
3.8
|
14.3
|
1.0
|
|
HG1
|
G:THR47
|
3.9
|
20.4
|
1.0
|
|
CA
|
G:CYS39
|
4.0
|
14.8
|
1.0
|
|
HA2
|
G:GLY41
|
4.0
|
22.7
|
1.0
|
|
N
|
G:ALA46
|
4.0
|
13.0
|
1.0
|
|
N
|
G:SER44
|
4.1
|
13.9
|
1.0
|
|
CA
|
G:CYS45
|
4.1
|
17.5
|
1.0
|
|
HA2
|
G:GLY37
|
4.1
|
26.8
|
1.0
|
|
H
|
G:SER42
|
4.1
|
16.8
|
1.0
|
|
H
|
G:ALA43
|
4.1
|
21.8
|
1.0
|
|
HB2
|
G:CYS39
|
4.2
|
16.8
|
1.0
|
|
N
|
G:GLY41
|
4.2
|
17.4
|
1.0
|
|
H
|
G:GLY40
|
4.2
|
19.5
|
1.0
|
|
HA
|
G:ALA43
|
4.3
|
22.9
|
1.0
|
|
C
|
G:CYS45
|
4.4
|
16.9
|
1.0
|
|
HB2
|
G:CYS45
|
4.4
|
16.0
|
1.0
|
|
HB3
|
G:CYS48
|
4.5
|
28.0
|
1.0
|
|
C
|
G:CYS39
|
4.5
|
17.3
|
1.0
|
|
HB2
|
G:SER44
|
4.5
|
18.7
|
1.0
|
|
SG
|
G:CYS86
|
4.5
|
12.8
|
1.0
|
|
H
|
G:ASP38
|
4.5
|
22.2
|
1.0
|
|
N
|
G:GLY40
|
4.5
|
16.3
|
1.0
|
|
CA
|
G:GLY41
|
4.6
|
18.9
|
1.0
|
|
N
|
G:ALA43
|
4.6
|
18.2
|
1.0
|
|
C
|
G:SER44
|
4.6
|
14.6
|
1.0
|
|
N
|
G:ASP38
|
4.6
|
18.5
|
1.0
|
|
N
|
G:THR47
|
4.6
|
11.9
|
1.0
|
|
N
|
G:SER42
|
4.7
|
14.0
|
1.0
|
|
C
|
G:GLY37
|
4.7
|
17.6
|
1.0
|
|
SG
|
G:CYS48
|
4.7
|
15.1
|
1.0
|
|
OG1
|
G:THR47
|
4.7
|
17.0
|
1.0
|
|
CA
|
G:SER44
|
4.8
|
14.9
|
1.0
|
|
C
|
G:ASP38
|
4.8
|
16.2
|
1.0
|
|
CA
|
G:ALA43
|
4.8
|
19.1
|
1.0
|
|
HA
|
G:CYS39
|
4.8
|
17.7
|
1.0
|
|
CA
|
G:GLY37
|
4.9
|
22.3
|
1.0
|
|
HB3
|
G:CYS86
|
4.9
|
14.0
|
1.0
|
|
HA
|
G:ALA46
|
4.9
|
18.9
|
1.0
|
|
C
|
G:ALA43
|
4.9
|
14.1
|
1.0
|
|
HA
|
G:CYS45
|
5.0
|
21.0
|
1.0
|
|
Iron binding site 10 out
of 12 in 4jx1
Go back to
Iron Binding Sites List in 4jx1
Iron binding site 10 out
of 12 in the Crystal Structure of Reduced Cytochrome P450CAM-Putidaredoxin Complex Bound to Camphor and 5-Exo-Hydroxycamphor
 Mono view
 Stereo pair view
|
|
A full contact list of Iron with other atoms in the Fe binding
site number 10 of Crystal Structure of Reduced Cytochrome P450CAM-Putidaredoxin Complex Bound to Camphor and 5-Exo-Hydroxycamphor within 5.0Å range:
|
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
G:Fe201
b:14.3
occ:1.00
|
FE2
|
G:FES201
|
0.0
|
14.3
|
1.0
|
|
S2
|
G:FES201
|
2.2
|
18.1
|
1.0
|
|
S1
|
G:FES201
|
2.2
|
17.3
|
1.0
|
|
SG
|
G:CYS86
|
2.3
|
12.8
|
1.0
|
|
SG
|
G:CYS48
|
2.3
|
15.1
|
1.0
|
|
FE1
|
G:FES201
|
2.8
|
13.4
|
1.0
|
|
HB3
|
G:CYS86
|
2.8
|
14.0
|
1.0
|
|
HB3
|
G:CYS48
|
3.1
|
28.0
|
1.0
|
|
CB
|
G:CYS86
|
3.2
|
11.6
|
1.0
|
|
CB
|
G:CYS48
|
3.4
|
23.4
|
1.0
|
|
HB3
|
G:LEU84
|
3.4
|
16.5
|
1.0
|
|
HA2
|
G:GLY41
|
3.5
|
22.7
|
1.0
|
|
H
|
G:CYS86
|
3.5
|
15.0
|
1.0
|
|
HB2
|
G:CYS86
|
3.8
|
14.0
|
1.0
|
|
H
|
G:ALA43
|
3.8
|
21.8
|
1.0
|
|
HB2
|
G:CYS48
|
3.9
|
28.0
|
1.0
|
|
HD22
|
G:LEU84
|
3.9
|
24.2
|
1.0
|
|
HA
|
G:ALA43
|
4.0
|
22.9
|
1.0
|
|
HD13
|
G:LEU84
|
4.0
|
34.9
|
1.0
|
|
HG3
|
G:MET24
|
4.0
|
13.2
|
1.0
|
|
H
|
G:CYS48
|
4.1
|
12.5
|
1.0
|
|
N
|
G:CYS86
|
4.2
|
12.5
|
1.0
|
|
CA
|
G:CYS86
|
4.3
|
11.4
|
1.0
|
|
H
|
G:ALA46
|
4.3
|
15.7
|
1.0
|
|
HA2
|
G:GLY37
|
4.3
|
26.8
|
1.0
|
|
CB
|
G:LEU84
|
4.3
|
13.7
|
1.0
|
|
CA
|
G:GLY41
|
4.4
|
18.9
|
1.0
|
|
H
|
G:GLY41
|
4.4
|
20.9
|
1.0
|
|
N
|
G:CYS48
|
4.5
|
10.4
|
1.0
|
|
SG
|
G:CYS39
|
4.5
|
14.3
|
1.0
|
|
N
|
G:ALA43
|
4.5
|
18.2
|
1.0
|
|
CA
|
G:CYS48
|
4.5
|
17.2
|
1.0
|
|
SG
|
G:CYS45
|
4.6
|
13.8
|
1.0
|
|
H
|
G:SER44
|
4.6
|
16.6
|
1.0
|
|
H
|
G:THR47
|
4.7
|
14.3
|
1.0
|
|
HA
|
G:ALA46
|
4.7
|
18.9
|
1.0
|
|
HE2
|
G:MET24
|
4.7
|
20.3
|
1.0
|
|
HB2
|
G:MET24
|
4.7
|
18.2
|
1.0
|
|
CA
|
G:ALA43
|
4.7
|
19.1
|
1.0
|
|
HB2
|
G:LEU84
|
4.8
|
16.5
|
1.0
|
|
CD2
|
G:LEU84
|
4.8
|
20.1
|
1.0
|
|
HE21
|
G:GLN87
|
4.8
|
26.0
|
1.0
|
|
H
|
G:CYS45
|
4.8
|
19.5
|
1.0
|
|
N
|
G:GLY41
|
4.8
|
17.4
|
1.0
|
|
CD1
|
G:LEU84
|
4.8
|
29.0
|
1.0
|
|
C
|
G:GLY41
|
4.9
|
21.4
|
1.0
|
|
N
|
G:ALA46
|
4.9
|
13.0
|
1.0
|
|
CG
|
G:LEU84
|
4.9
|
20.4
|
1.0
|
|
HA
|
G:CYS86
|
4.9
|
13.7
|
1.0
|
|
CG
|
G:MET24
|
5.0
|
11.0
|
1.0
|
|
H
|
G:SER42
|
5.0
|
16.8
|
1.0
|
|
HG2
|
G:GLN87
|
5.0
|
30.4
|
1.0
|
|
Reference:
S.Tripathi,
H.Li,
T.L.Poulos.
Structural Basis For Effector Control and Redox Partner Recognition in Cytochrome P450. Science V. 340 1227 2013.
ISSN: ISSN 0036-8075
PubMed: 23744947
DOI: 10.1126/SCIENCE.1235797
Page generated: Mon Aug 5 04:53:24 2024
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