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Copper in PDB 5xmo: X-Ray Crystal Structure of Pseudoazurin MET16PHE/THR36LYS Variant

Protein crystallography data

The structure of X-Ray Crystal Structure of Pseudoazurin MET16PHE/THR36LYS Variant, PDB code: 5xmo was solved by T.Yamaguchi, T.Kohzuma, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 46.05 / 1.19
Space group C 1 2 1
Cell size a, b, c (Å), α, β, γ (°) 93.170, 41.160, 34.830, 90.00, 98.71, 90.00
R / Rfree (%) 12.8 / 16.1

Copper Binding Sites:

The binding sites of Copper atom in the X-Ray Crystal Structure of Pseudoazurin MET16PHE/THR36LYS Variant (pdb code 5xmo). This binding sites where shown within 5.0 Angstroms radius around Copper atom.
In total 2 binding sites of Copper where determined in the X-Ray Crystal Structure of Pseudoazurin MET16PHE/THR36LYS Variant, PDB code: 5xmo:
Jump to Copper binding site number: 1; 2;

Copper binding site 1 out of 2 in 5xmo

Go back to Copper Binding Sites List in 5xmo
Copper binding site 1 out of 2 in the X-Ray Crystal Structure of Pseudoazurin MET16PHE/THR36LYS Variant


Mono view


Stereo pair view

A full contact list of Copper with other atoms in the Cu binding site number 1 of X-Ray Crystal Structure of Pseudoazurin MET16PHE/THR36LYS Variant within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cu201

b:9.5
occ:0.50
CU A:CU201 0.0 9.5 0.5
CU A:CU201 0.5 6.3 0.5
ND1 A:HIS81 2.0 8.9 1.0
ND1 A:HIS40 2.0 7.8 1.0
SG A:CYS78 2.1 9.1 1.0
CE1 A:HIS81 2.9 9.0 1.0
SD A:MET86 3.0 6.4 1.0
CE1 A:HIS40 3.0 8.1 1.0
CG A:HIS81 3.1 7.9 1.0
CG A:HIS40 3.1 7.8 1.0
CB A:CYS78 3.2 6.8 1.0
CB A:HIS40 3.5 7.5 1.0
CB A:HIS81 3.5 7.5 1.0
CA A:HIS40 3.5 8.1 1.0
O A:GLY39 3.5 11.9 1.0
CE A:MET86 3.7 7.6 1.0
CG A:PRO80 4.0 11.7 1.0
NE2 A:HIS81 4.1 9.7 1.0
C A:GLY39 4.2 9.9 1.0
NE2 A:HIS40 4.2 8.3 1.0
CD2 A:HIS81 4.2 9.8 1.0
N A:HIS81 4.2 7.5 1.0
CD2 A:HIS40 4.2 10.0 1.0
N A:HIS40 4.3 9.2 1.0
CG A:MET86 4.4 5.8 1.0
CA A:HIS81 4.5 7.1 1.0
CA A:CYS78 4.5 5.9 1.0
N A:ASN41 4.6 9.2 1.0
CD A:PRO80 4.7 9.2 1.0
C A:HIS40 4.7 9.6 1.0
CB A:MET86 4.8 5.1 1.0
C A:CYS78 4.9 6.4 1.0
O A:CYS78 5.0 8.3 1.0
CB A:PRO80 5.0 10.6 1.0

Copper binding site 2 out of 2 in 5xmo

Go back to Copper Binding Sites List in 5xmo
Copper binding site 2 out of 2 in the X-Ray Crystal Structure of Pseudoazurin MET16PHE/THR36LYS Variant


Mono view


Stereo pair view

A full contact list of Copper with other atoms in the Cu binding site number 2 of X-Ray Crystal Structure of Pseudoazurin MET16PHE/THR36LYS Variant within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cu201

b:6.3
occ:0.50
CU A:CU201 0.0 6.3 0.5
CU A:CU201 0.5 9.5 0.5
ND1 A:HIS40 2.0 7.8 1.0
ND1 A:HIS81 2.1 8.9 1.0
SG A:CYS78 2.3 9.1 1.0
SD A:MET86 2.5 6.4 1.0
CE1 A:HIS40 2.9 8.1 1.0
CE1 A:HIS81 3.1 9.0 1.0
CG A:HIS81 3.1 7.9 1.0
CG A:HIS40 3.1 7.8 1.0
CB A:CYS78 3.2 6.8 1.0
CE A:MET86 3.3 7.6 1.0
CB A:HIS81 3.4 7.5 1.0
CB A:HIS40 3.5 7.5 1.0
CA A:HIS40 3.8 8.1 1.0
O A:GLY39 3.9 11.9 1.0
CG A:MET86 4.0 5.8 1.0
NE2 A:HIS40 4.1 8.3 1.0
CD2 A:HIS40 4.2 10.0 1.0
CD2 A:HIS81 4.2 9.8 1.0
NE2 A:HIS81 4.2 9.7 1.0
N A:HIS81 4.3 7.5 1.0
CB A:MET86 4.4 5.1 1.0
CG A:PRO80 4.5 11.7 1.0
CA A:HIS81 4.5 7.1 1.0
C A:GLY39 4.5 9.9 1.0
N A:HIS40 4.6 9.2 1.0
CA A:CYS78 4.6 5.9 1.0
CD1 A:PHE16 4.8 9.7 1.0
N A:ASN41 4.9 9.2 1.0
C A:HIS40 4.9 9.6 1.0
C A:CYS78 5.0 6.4 1.0

Reference:

T.Yamaguchi, N.Takebayashi, K.Akao, C.Sakai, T.Kohzuma. X-Ray Crystallographic Analysis of M16F/T36K Double Mutant of Pseudoazurin Photon Factory Activity V. 34 2017REPORT.
ISSN: ISSN 0912-1803
Page generated: Wed Jul 31 05:22:51 2024

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