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Iron in PDB 2ca0: Crystal Structure of Yc-17-Bound Cytochrome P450 Pikc ( CYP107L1)

Protein crystallography data

The structure of Crystal Structure of Yc-17-Bound Cytochrome P450 Pikc ( CYP107L1), PDB code: 2ca0 was solved by L.I.Yermalitskaya, Y.Kim, D.H.Sherman, M.R.Waterman, L.M.Podust, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 32.41 / 2.85
Space group P 1 21 1
Cell size a, b, c (Å), α, β, γ (°) 61.088, 91.972, 68.901, 90.00, 89.92, 90.00
R / Rfree (%) 24 / 33.8

Iron Binding Sites:

The binding sites of Iron atom in the Crystal Structure of Yc-17-Bound Cytochrome P450 Pikc ( CYP107L1) (pdb code 2ca0). This binding sites where shown within 5.0 Angstroms radius around Iron atom.
In total 2 binding sites of Iron where determined in the Crystal Structure of Yc-17-Bound Cytochrome P450 Pikc ( CYP107L1), PDB code: 2ca0:
Jump to Iron binding site number: 1; 2;

Iron binding site 1 out of 2 in 2ca0

Go back to Iron Binding Sites List in 2ca0
Iron binding site 1 out of 2 in the Crystal Structure of Yc-17-Bound Cytochrome P450 Pikc ( CYP107L1)


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 Yc-17-Bound Cytochrome P450 Pikc ( CYP107L1) within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Fe1407

b:4.4
occ:1.00
FE A:HEM1407 0.0 4.4 1.0
NB A:HEM1407 1.9 4.1 1.0
NA A:HEM1407 2.0 5.0 1.0
ND A:HEM1407 2.0 6.2 1.0
NC A:HEM1407 2.0 5.7 1.0
SG A:CYS354 3.0 18.8 1.0
C4A A:HEM1407 3.0 4.8 1.0
C1B A:HEM1407 3.0 3.9 1.0
C4B A:HEM1407 3.0 4.8 1.0
C1D A:HEM1407 3.0 5.0 1.0
C1A A:HEM1407 3.1 4.1 1.0
C4D A:HEM1407 3.1 6.2 1.0
C1C A:HEM1407 3.1 4.8 1.0
C4C A:HEM1407 3.1 4.8 1.0
O A:ALA243 3.3 29.2 1.0
CHB A:HEM1407 3.4 3.8 1.0
CHD A:HEM1407 3.4 4.2 1.0
CHC A:HEM1407 3.4 4.8 1.0
CHA A:HEM1407 3.5 3.9 1.0
CB A:CYS354 3.6 15.4 1.0
C1 A:PXI1408 4.1 32.5 1.0
CA A:CYS354 4.1 12.9 1.0
C3A A:HEM1407 4.2 4.8 1.0
C3B A:HEM1407 4.2 4.4 1.0
C2B A:HEM1407 4.2 3.6 1.0
C2D A:HEM1407 4.3 6.9 1.0
C2A A:HEM1407 4.3 4.7 1.0
C3D A:HEM1407 4.3 7.3 1.0
C2C A:HEM1407 4.3 5.7 1.0
C3C A:HEM1407 4.4 4.2 1.0
C A:ALA243 4.5 28.1 1.0
N A:GLY356 4.8 12.5 1.0
N A:ILE355 4.8 10.5 1.0
C A:CYS354 4.8 11.3 1.0

Iron binding site 2 out of 2 in 2ca0

Go back to Iron Binding Sites List in 2ca0
Iron binding site 2 out of 2 in the Crystal Structure of Yc-17-Bound Cytochrome P450 Pikc ( CYP107L1)


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 Yc-17-Bound Cytochrome P450 Pikc ( CYP107L1) within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Fe1407

b:9.4
occ:1.00
FE B:HEM1407 0.0 9.4 1.0
NC B:HEM1407 2.0 4.0 1.0
ND B:HEM1407 2.0 5.1 1.0
NB B:HEM1407 2.0 5.3 1.0
NA B:HEM1407 2.0 8.1 1.0
SG B:CYS354 2.8 9.0 1.0
C1C B:HEM1407 3.0 5.2 1.0
C4C B:HEM1407 3.0 3.4 1.0
C1D B:HEM1407 3.0 3.1 1.0
C4B B:HEM1407 3.1 6.4 1.0
C4D B:HEM1407 3.1 6.5 1.0
C1B B:HEM1407 3.1 5.8 1.0
C1A B:HEM1407 3.1 8.0 1.0
C4A B:HEM1407 3.1 8.6 1.0
CHC B:HEM1407 3.4 6.5 1.0
CHD B:HEM1407 3.4 3.1 1.0
CHA B:HEM1407 3.5 8.1 1.0
CHB B:HEM1407 3.5 8.3 1.0
CB B:CYS354 3.9 9.4 1.0
C3C B:HEM1407 4.3 5.0 1.0
C2C B:HEM1407 4.3 6.4 1.0
C2D B:HEM1407 4.3 3.9 1.0
CA B:CYS354 4.3 9.3 1.0
C1 B:PXI1408 4.3 32.6 1.0
C3D B:HEM1407 4.3 7.6 1.0
C3B B:HEM1407 4.3 5.0 1.0
C2B B:HEM1407 4.3 5.3 1.0
C2A B:HEM1407 4.4 8.9 1.0
C3A B:HEM1407 4.4 7.8 1.0
N B:GLY356 4.4 6.9 1.0
N B:ILE355 4.6 7.0 1.0
CA B:GLY356 4.7 10.2 1.0
CB B:ALA243 4.7 25.1 1.0
C B:CYS354 4.9 8.4 1.0
N B:GLY244 5.0 26.4 1.0

Reference:

L.I.Yermalitskaya, Y.Kim, D.H.Sherman, M.R.Waterman, L.M.Podust. Crystal Structure of Yc-17-Bound Cytochrome P450 Pikc (CYP107L1) To Be Published.
Page generated: Sat Aug 3 20:07:23 2024

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