Iron in PDB 1rof: uc(Nmr) Study of 4FE-4S Ferredoxin of Thermatoga Maritima
Iron Binding Sites:
The binding sites of Iron atom in the uc(Nmr) Study of 4FE-4S Ferredoxin of Thermatoga Maritima
(pdb code 1rof). This binding sites where shown within
5.0 Angstroms radius around Iron atom.
In total 4 binding sites of Iron where determined in the
uc(Nmr) Study of 4FE-4S Ferredoxin of Thermatoga Maritima, PDB code: 1rof:
Jump to Iron binding site number:
1;
2;
3;
4;
Iron binding site 1 out
of 4 in 1rof
Go back to
Iron Binding Sites List in 1rof
Iron binding site 1 out
of 4 in the uc(Nmr) Study of 4FE-4S Ferredoxin of Thermatoga Maritima
Mono view
Stereo pair view
|
A full contact list of Iron with other atoms in the Fe binding
site number 1 of uc(Nmr) Study of 4FE-4S Ferredoxin of Thermatoga Maritima within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Fe61
b:0.0
occ:1.00
|
FE1
|
A:SF461
|
0.0
|
0.0
|
1.0
|
S2
|
A:SF461
|
2.3
|
0.0
|
1.0
|
S4
|
A:SF461
|
2.3
|
0.0
|
1.0
|
S3
|
A:SF461
|
2.3
|
0.0
|
1.0
|
SG
|
A:CYS10
|
2.3
|
0.0
|
1.0
|
HB2
|
A:ALA32
|
2.4
|
0.0
|
1.0
|
FE3
|
A:SF461
|
2.7
|
0.0
|
1.0
|
FE4
|
A:SF461
|
2.7
|
0.0
|
1.0
|
FE2
|
A:SF461
|
2.7
|
0.0
|
1.0
|
HB1
|
A:ALA32
|
3.1
|
0.0
|
1.0
|
HG23
|
A:THR53
|
3.2
|
0.0
|
1.0
|
CB
|
A:ALA32
|
3.2
|
0.0
|
1.0
|
H
|
A:ILE11
|
3.2
|
0.0
|
1.0
|
O
|
A:ALA32
|
3.4
|
0.0
|
1.0
|
HB2
|
A:CYS10
|
3.4
|
0.0
|
1.0
|
CB
|
A:CYS10
|
3.4
|
0.0
|
1.0
|
HA
|
A:CYS10
|
3.5
|
0.0
|
1.0
|
H
|
A:CYS13
|
3.5
|
0.0
|
1.0
|
H
|
A:GLY12
|
3.8
|
0.0
|
1.0
|
S1
|
A:SF461
|
3.8
|
0.0
|
1.0
|
HB3
|
A:ALA32
|
3.9
|
0.0
|
1.0
|
CA
|
A:CYS10
|
3.9
|
0.0
|
1.0
|
HG22
|
A:THR53
|
4.0
|
0.0
|
1.0
|
N
|
A:ILE11
|
4.0
|
0.0
|
1.0
|
CG2
|
A:THR53
|
4.0
|
0.0
|
1.0
|
HB
|
A:THR53
|
4.2
|
0.0
|
1.0
|
HA2
|
A:GLY12
|
4.2
|
0.0
|
1.0
|
C
|
A:ALA32
|
4.2
|
0.0
|
1.0
|
N
|
A:GLY12
|
4.2
|
0.0
|
1.0
|
CA
|
A:ALA32
|
4.3
|
0.0
|
1.0
|
H
|
A:GLY14
|
4.3
|
0.0
|
1.0
|
HB3
|
A:CYS10
|
4.4
|
0.0
|
1.0
|
H
|
A:ALA32
|
4.4
|
0.0
|
1.0
|
HD2
|
A:PRO52
|
4.4
|
0.0
|
1.0
|
C
|
A:CYS10
|
4.4
|
0.0
|
1.0
|
N
|
A:CYS13
|
4.5
|
0.0
|
1.0
|
HG21
|
A:ILE11
|
4.6
|
0.0
|
1.0
|
CB
|
A:THR53
|
4.7
|
0.0
|
1.0
|
CA
|
A:GLY12
|
4.7
|
0.0
|
1.0
|
SG
|
A:CYS16
|
4.8
|
0.0
|
1.0
|
SG
|
A:CYS51
|
4.8
|
0.0
|
1.0
|
SG
|
A:CYS13
|
4.8
|
0.0
|
1.0
|
N
|
A:ALA32
|
4.8
|
0.0
|
1.0
|
H
|
A:VAL15
|
4.8
|
0.0
|
1.0
|
HG21
|
A:THR53
|
4.8
|
0.0
|
1.0
|
C
|
A:ILE11
|
4.9
|
0.0
|
1.0
|
|
Iron binding site 2 out
of 4 in 1rof
Go back to
Iron Binding Sites List in 1rof
Iron binding site 2 out
of 4 in the uc(Nmr) Study of 4FE-4S Ferredoxin of Thermatoga Maritima
Mono view
Stereo pair view
|
A full contact list of Iron with other atoms in the Fe binding
site number 2 of uc(Nmr) Study of 4FE-4S Ferredoxin of Thermatoga Maritima within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Fe61
b:0.0
occ:1.00
|
FE2
|
A:SF461
|
0.0
|
0.0
|
1.0
|
S1
|
A:SF461
|
2.2
|
0.0
|
1.0
|
S4
|
A:SF461
|
2.3
|
0.0
|
1.0
|
S3
|
A:SF461
|
2.3
|
0.0
|
1.0
|
SG
|
A:CYS13
|
2.3
|
0.0
|
1.0
|
H
|
A:GLY14
|
2.6
|
0.0
|
1.0
|
H
|
A:VAL15
|
2.7
|
0.0
|
1.0
|
FE3
|
A:SF461
|
2.7
|
0.0
|
1.0
|
FE4
|
A:SF461
|
2.7
|
0.0
|
1.0
|
FE1
|
A:SF461
|
2.7
|
0.0
|
1.0
|
HB
|
A:VAL15
|
2.8
|
0.0
|
1.0
|
HD2
|
A:PRO52
|
2.9
|
0.0
|
1.0
|
H
|
A:CYS13
|
2.9
|
0.0
|
1.0
|
CB
|
A:CYS13
|
3.5
|
0.0
|
1.0
|
N
|
A:GLY14
|
3.5
|
0.0
|
1.0
|
N
|
A:VAL15
|
3.5
|
0.0
|
1.0
|
HB3
|
A:CYS13
|
3.5
|
0.0
|
1.0
|
HG2
|
A:PRO52
|
3.6
|
0.0
|
1.0
|
CD
|
A:PRO52
|
3.7
|
0.0
|
1.0
|
N
|
A:CYS13
|
3.7
|
0.0
|
1.0
|
S2
|
A:SF461
|
3.8
|
0.0
|
1.0
|
CB
|
A:VAL15
|
3.8
|
0.0
|
1.0
|
HD3
|
A:PRO52
|
3.9
|
0.0
|
1.0
|
CA
|
A:CYS13
|
4.0
|
0.0
|
1.0
|
CG
|
A:PRO52
|
4.1
|
0.0
|
1.0
|
H
|
A:CYS16
|
4.1
|
0.0
|
1.0
|
HA
|
A:CYS51
|
4.1
|
0.0
|
1.0
|
C
|
A:CYS13
|
4.2
|
0.0
|
1.0
|
HG23
|
A:THR53
|
4.2
|
0.0
|
1.0
|
HG3
|
A:PRO52
|
4.2
|
0.0
|
1.0
|
CA
|
A:VAL15
|
4.3
|
0.0
|
1.0
|
HG13
|
A:VAL15
|
4.3
|
0.0
|
1.0
|
HB2
|
A:ALA32
|
4.3
|
0.0
|
1.0
|
H
|
A:ILE11
|
4.4
|
0.0
|
1.0
|
HG21
|
A:ILE11
|
4.4
|
0.0
|
1.0
|
HB2
|
A:CYS13
|
4.4
|
0.0
|
1.0
|
C
|
A:GLY14
|
4.4
|
0.0
|
1.0
|
CA
|
A:GLY14
|
4.5
|
0.0
|
1.0
|
CG1
|
A:VAL15
|
4.6
|
0.0
|
1.0
|
HG22
|
A:VAL15
|
4.6
|
0.0
|
1.0
|
HA2
|
A:GLY14
|
4.7
|
0.0
|
1.0
|
N
|
A:CYS16
|
4.7
|
0.0
|
1.0
|
H
|
A:THR53
|
4.7
|
0.0
|
1.0
|
SG
|
A:CYS16
|
4.7
|
0.0
|
1.0
|
SG
|
A:CYS51
|
4.8
|
0.0
|
1.0
|
SG
|
A:CYS10
|
4.8
|
0.0
|
1.0
|
HB1
|
A:ALA32
|
4.8
|
0.0
|
1.0
|
HG12
|
A:VAL15
|
4.8
|
0.0
|
1.0
|
CG2
|
A:VAL15
|
4.8
|
0.0
|
1.0
|
C
|
A:VAL15
|
4.9
|
0.0
|
1.0
|
C
|
A:GLY12
|
4.9
|
0.0
|
1.0
|
HA2
|
A:GLY12
|
5.0
|
0.0
|
1.0
|
N
|
A:PRO52
|
5.0
|
0.0
|
1.0
|
CB
|
A:ALA32
|
5.0
|
0.0
|
1.0
|
|
Iron binding site 3 out
of 4 in 1rof
Go back to
Iron Binding Sites List in 1rof
Iron binding site 3 out
of 4 in the uc(Nmr) Study of 4FE-4S Ferredoxin of Thermatoga Maritima
Mono view
Stereo pair view
|
A full contact list of Iron with other atoms in the Fe binding
site number 3 of uc(Nmr) Study of 4FE-4S Ferredoxin of Thermatoga Maritima within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Fe61
b:0.0
occ:1.00
|
FE3
|
A:SF461
|
0.0
|
0.0
|
1.0
|
S1
|
A:SF461
|
2.2
|
0.0
|
1.0
|
S4
|
A:SF461
|
2.2
|
0.0
|
1.0
|
S2
|
A:SF461
|
2.3
|
0.0
|
1.0
|
SG
|
A:CYS16
|
2.3
|
0.0
|
1.0
|
FE2
|
A:SF461
|
2.7
|
0.0
|
1.0
|
FE1
|
A:SF461
|
2.7
|
0.0
|
1.0
|
FE4
|
A:SF461
|
2.7
|
0.0
|
1.0
|
HB2
|
A:ALA32
|
2.8
|
0.0
|
1.0
|
H
|
A:CYS16
|
3.0
|
0.0
|
1.0
|
HB3
|
A:CYS16
|
3.1
|
0.0
|
1.0
|
H
|
A:VAL15
|
3.2
|
0.0
|
1.0
|
CB
|
A:CYS16
|
3.3
|
0.0
|
1.0
|
N
|
A:CYS16
|
3.6
|
0.0
|
1.0
|
CB
|
A:ALA32
|
3.6
|
0.0
|
1.0
|
HB3
|
A:ALA32
|
3.7
|
0.0
|
1.0
|
H
|
A:GLY14
|
3.8
|
0.0
|
1.0
|
S3
|
A:SF461
|
3.8
|
0.0
|
1.0
|
N
|
A:VAL15
|
4.0
|
0.0
|
1.0
|
CA
|
A:CYS16
|
4.1
|
0.0
|
1.0
|
HB1
|
A:ALA32
|
4.1
|
0.0
|
1.0
|
HB2
|
A:CYS16
|
4.2
|
0.0
|
1.0
|
HB
|
A:VAL15
|
4.2
|
0.0
|
1.0
|
O
|
A:ALA32
|
4.3
|
0.0
|
1.0
|
HG13
|
A:VAL15
|
4.4
|
0.0
|
1.0
|
C
|
A:VAL15
|
4.4
|
0.0
|
1.0
|
H
|
A:GLU17
|
4.4
|
0.0
|
1.0
|
H
|
A:CYS13
|
4.4
|
0.0
|
1.0
|
HG23
|
A:THR53
|
4.5
|
0.0
|
1.0
|
HD2
|
A:PRO52
|
4.6
|
0.0
|
1.0
|
N
|
A:GLY14
|
4.6
|
0.0
|
1.0
|
HA2
|
A:GLY14
|
4.6
|
0.0
|
1.0
|
O
|
A:GLN25
|
4.6
|
0.0
|
1.0
|
CA
|
A:VAL15
|
4.7
|
0.0
|
1.0
|
HA
|
A:CYS16
|
4.7
|
0.0
|
1.0
|
SG
|
A:CYS13
|
4.7
|
0.0
|
1.0
|
SG
|
A:CYS10
|
4.8
|
0.0
|
1.0
|
SG
|
A:CYS51
|
4.8
|
0.0
|
1.0
|
CB
|
A:VAL15
|
4.8
|
0.0
|
1.0
|
C
|
A:ALA32
|
4.9
|
0.0
|
1.0
|
CA
|
A:ALA32
|
4.9
|
0.0
|
1.0
|
HA
|
A:CYS51
|
4.9
|
0.0
|
1.0
|
C
|
A:GLY14
|
5.0
|
0.0
|
1.0
|
CA
|
A:GLY14
|
5.0
|
0.0
|
1.0
|
|
Iron binding site 4 out
of 4 in 1rof
Go back to
Iron Binding Sites List in 1rof
Iron binding site 4 out
of 4 in the uc(Nmr) Study of 4FE-4S Ferredoxin of Thermatoga Maritima
Mono view
Stereo pair view
|
A full contact list of Iron with other atoms in the Fe binding
site number 4 of uc(Nmr) Study of 4FE-4S Ferredoxin of Thermatoga Maritima within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Fe61
b:0.0
occ:1.00
|
FE4
|
A:SF461
|
0.0
|
0.0
|
1.0
|
HG23
|
A:THR53
|
2.2
|
0.0
|
1.0
|
S1
|
A:SF461
|
2.2
|
0.0
|
1.0
|
S2
|
A:SF461
|
2.3
|
0.0
|
1.0
|
S3
|
A:SF461
|
2.3
|
0.0
|
1.0
|
SG
|
A:CYS51
|
2.3
|
0.0
|
1.0
|
HD2
|
A:PRO52
|
2.7
|
0.0
|
1.0
|
FE2
|
A:SF461
|
2.7
|
0.0
|
1.0
|
FE1
|
A:SF461
|
2.7
|
0.0
|
1.0
|
FE3
|
A:SF461
|
2.7
|
0.0
|
1.0
|
CG2
|
A:THR53
|
3.2
|
0.0
|
1.0
|
HA
|
A:CYS51
|
3.3
|
0.0
|
1.0
|
H
|
A:THR53
|
3.3
|
0.0
|
1.0
|
CB
|
A:CYS51
|
3.4
|
0.0
|
1.0
|
HB2
|
A:CYS51
|
3.5
|
0.0
|
1.0
|
HG21
|
A:THR53
|
3.5
|
0.0
|
1.0
|
CD
|
A:PRO52
|
3.7
|
0.0
|
1.0
|
HG22
|
A:THR53
|
3.7
|
0.0
|
1.0
|
CA
|
A:CYS51
|
3.8
|
0.0
|
1.0
|
S4
|
A:SF461
|
3.8
|
0.0
|
1.0
|
HG13
|
A:VAL15
|
4.0
|
0.0
|
1.0
|
HB
|
A:VAL15
|
4.1
|
0.0
|
1.0
|
HB
|
A:THR53
|
4.1
|
0.0
|
1.0
|
HD3
|
A:PRO52
|
4.2
|
0.0
|
1.0
|
CB
|
A:THR53
|
4.2
|
0.0
|
1.0
|
HB1
|
A:ALA55
|
4.2
|
0.0
|
1.0
|
N
|
A:THR53
|
4.3
|
0.0
|
1.0
|
N
|
A:PRO52
|
4.3
|
0.0
|
1.0
|
HB3
|
A:CYS16
|
4.3
|
0.0
|
1.0
|
C
|
A:CYS51
|
4.4
|
0.0
|
1.0
|
HG2
|
A:PRO52
|
4.4
|
0.0
|
1.0
|
HB3
|
A:CYS51
|
4.4
|
0.0
|
1.0
|
HB2
|
A:ALA32
|
4.4
|
0.0
|
1.0
|
HA
|
A:CYS10
|
4.5
|
0.0
|
1.0
|
H
|
A:VAL15
|
4.5
|
0.0
|
1.0
|
H
|
A:ALA55
|
4.7
|
0.0
|
1.0
|
CG
|
A:PRO52
|
4.7
|
0.0
|
1.0
|
CG1
|
A:VAL15
|
4.7
|
0.0
|
1.0
|
HB2
|
A:CYS10
|
4.8
|
0.0
|
1.0
|
SG
|
A:CYS13
|
4.8
|
0.0
|
1.0
|
HG12
|
A:VAL15
|
4.8
|
0.0
|
1.0
|
SG
|
A:CYS16
|
4.8
|
0.0
|
1.0
|
SG
|
A:CYS10
|
4.8
|
0.0
|
1.0
|
CA
|
A:THR53
|
4.8
|
0.0
|
1.0
|
CB
|
A:VAL15
|
4.8
|
0.0
|
1.0
|
H
|
A:ILE11
|
4.9
|
0.0
|
1.0
|
O
|
A:ALA32
|
4.9
|
0.0
|
1.0
|
H
|
A:CYS16
|
5.0
|
0.0
|
1.0
|
|
Reference:
H.Sticht,
G.Wildegger,
D.Bentrop,
B.Darimont,
R.Sterner,
P.Rosch.
An uc(Nmr)-Derived Model For the Solution Structure of Oxidized Thermotoga Maritima 1[FE4-S4] Ferredoxin. Eur.J.Biochem. V. 237 726 1996.
ISSN: ISSN 0014-2956
PubMed: 8647119
DOI: 10.1111/J.1432-1033.1996.0726P.X
Page generated: Sat Aug 3 14:17:28 2024
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