Atomistry » Copper » PDB 1hc1-1jvo » 1j9q
Atomistry »
  Copper »
    PDB 1hc1-1jvo »
      1j9q »

Copper in PDB 1j9q: Crystal Structure of Nitrite Soaked Oxidized D98N Afnir

Enzymatic activity of Crystal Structure of Nitrite Soaked Oxidized D98N Afnir

All present enzymatic activity of Crystal Structure of Nitrite Soaked Oxidized D98N Afnir:
1.7.99.3;

Protein crystallography data

The structure of Crystal Structure of Nitrite Soaked Oxidized D98N Afnir, PDB code: 1j9q was solved by M.J.Boulanger, M.E.Murphy, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 50.00 / 1.65
Space group P 21 21 21
Cell size a, b, c (Å), α, β, γ (°) 61.921, 102.485, 145.845, 90.00, 90.00, 90.00
R / Rfree (%) 17.9 / 21

Copper Binding Sites:

The binding sites of Copper atom in the Crystal Structure of Nitrite Soaked Oxidized D98N Afnir (pdb code 1j9q). This binding sites where shown within 5.0 Angstroms radius around Copper atom.
In total 6 binding sites of Copper where determined in the Crystal Structure of Nitrite Soaked Oxidized D98N Afnir, PDB code: 1j9q:
Jump to Copper binding site number: 1; 2; 3; 4; 5; 6;

Copper binding site 1 out of 6 in 1j9q

Go back to Copper Binding Sites List in 1j9q
Copper binding site 1 out of 6 in the Crystal Structure of Nitrite Soaked Oxidized D98N Afnir


Mono view


Stereo pair view

A full contact list of Copper with other atoms in the Cu binding site number 1 of Crystal Structure of Nitrite Soaked Oxidized D98N Afnir within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cu601

b:14.7
occ:1.00
 ND1 A:HIS145 2.0 11.8 1.0
ND1 A:HIS95 2.1 10.5 1.0
SG A:CYS136 2.2 12.4 1.0
SD A:MET150 2.4 10.7 1.0
CE1 A:HIS145 2.9 12.0 1.0
CE1 A:HIS95 3.0 11.1 1.0
CG A:HIS145 3.1 12.0 1.0
CG A:HIS95 3.1 11.3 1.0
CB A:CYS136 3.2 11.6 1.0
CE A:MET150 3.3 10.8 1.0
CB A:HIS95 3.5 11.3 1.0
CB A:HIS145 3.5 11.6 1.0
CG A:MET150 3.8 9.9 1.0
CA A:HIS95 3.9 11.9 1.0
NE2 A:HIS145 4.0 12.0 1.0
NE2 A:HIS95 4.1 11.0 1.0
CD2 A:HIS145 4.2 12.1 1.0
CD2 A:HIS95 4.2 10.9 1.0
CG A:PRO138 4.2 13.9 1.0
CB A:MET150 4.3 9.6 1.0
O A:MET94 4.3 13.1 1.0
SD A:MET62 4.4 12.9 1.0
CA A:CYS136 4.6 11.5 1.0
N A:ASN96 4.6 12.3 1.0
CD A:PRO138 4.7 13.5 1.0
CB A:MET62 4.7 12.8 1.0
CA A:HIS145 4.8 11.6 1.0
C A:HIS95 4.9 12.0 1.0
N A:HIS95 4.9 12.5 1.0

Copper binding site 2 out of 6 in 1j9q

Go back to Copper Binding Sites List in 1j9q
Copper binding site 2 out of 6 in the Crystal Structure of Nitrite Soaked Oxidized D98N Afnir


Mono view


Stereo pair view

A full contact list of Copper with other atoms in the Cu binding site number 2 of Crystal Structure of Nitrite Soaked Oxidized D98N Afnir within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cu602

b:14.1
occ:1.00
 NE2 A:HIS100 2.0 11.2 1.0
NE2 B:HIS306 2.0 10.2 1.0
NE2 A:HIS135 2.1 10.4 1.0
O2 B:NO2604 2.3 40.1 1.0
O1 B:NO2604 2.5 39.8 1.0
N B:NO2604 2.5 39.7 1.0
CE1 A:HIS100 2.9 11.1 1.0
CE1 B:HIS306 2.9 10.3 1.0
CD2 A:HIS100 3.1 10.6 1.0
CD2 A:HIS135 3.1 10.3 1.0
CD2 B:HIS306 3.1 10.0 1.0
CE1 A:HIS135 3.1 10.1 1.0
ND1 A:HIS100 4.1 10.6 1.0
ND1 B:HIS306 4.1 10.2 1.0
CG A:HIS100 4.2 10.7 1.0
CG B:HIS306 4.2 9.9 1.0
ND1 A:HIS135 4.2 9.8 1.0
NE2 B:HIS255 4.2 13.7 1.0
CG A:HIS135 4.2 9.8 1.0
ND2 A:ASN98 4.3 18.8 1.0
CE1 B:HIS255 4.4 14.1 1.0
CD2 B:HIS255 4.5 13.8 1.0
CG A:ASN98 4.6 17.0 1.0
OD1 A:ASN98 4.6 18.2 1.0
ND1 B:HIS255 4.8 13.3 1.0
CD2 B:LEU308 4.9 10.5 1.0
CG B:HIS255 4.9 13.2 1.0

Copper binding site 3 out of 6 in 1j9q

Go back to Copper Binding Sites List in 1j9q
Copper binding site 3 out of 6 in the Crystal Structure of Nitrite Soaked Oxidized D98N Afnir


Mono view


Stereo pair view

A full contact list of Copper with other atoms in the Cu binding site number 3 of Crystal Structure of Nitrite Soaked Oxidized D98N Afnir within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Cu701

b:16.7
occ:1.00
 ND1 B:HIS95 2.1 13.4 1.0
ND1 B:HIS145 2.1 15.2 1.0
SG B:CYS136 2.2 15.3 1.0
SD B:MET150 2.4 11.9 1.0
CE1 B:HIS95 3.0 13.8 1.0
CE1 B:HIS145 3.0 14.9 1.0
CG B:HIS95 3.1 14.2 1.0
CB B:CYS136 3.1 14.2 1.0
CG B:HIS145 3.2 14.8 1.0
CE B:MET150 3.2 13.0 1.0
CB B:HIS95 3.4 14.5 1.0
CB B:HIS145 3.6 14.5 1.0
CG B:MET150 3.8 12.0 1.0
CA B:HIS95 3.8 15.2 1.0
NE2 B:HIS95 4.1 13.4 1.0
CG B:PRO138 4.1 15.0 1.0
NE2 B:HIS145 4.2 15.0 1.0
CD2 B:HIS95 4.2 13.5 1.0
O B:MET94 4.3 16.4 1.0
CD2 B:HIS145 4.3 15.3 1.0
CB B:MET150 4.4 11.7 1.0
SD B:MET62 4.4 15.2 1.0
CD B:PRO138 4.6 14.7 1.0
CA B:CYS136 4.6 14.0 1.0
N B:ASN96 4.7 15.5 1.0
CA B:HIS145 4.8 14.1 1.0
CB B:MET62 4.8 14.7 1.0
C B:HIS95 4.8 15.3 1.0
N B:HIS95 4.9 15.7 1.0
C B:MET94 5.0 16.4 1.0

Copper binding site 4 out of 6 in 1j9q

Go back to Copper Binding Sites List in 1j9q
Copper binding site 4 out of 6 in the Crystal Structure of Nitrite Soaked Oxidized D98N Afnir


Mono view


Stereo pair view

A full contact list of Copper with other atoms in the Cu binding site number 4 of Crystal Structure of Nitrite Soaked Oxidized D98N Afnir within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Cu702

b:16.4
occ:1.00
 NE2 B:HIS100 2.0 12.1 1.0
NE2 C:HIS306 2.1 12.7 1.0
NE2 B:HIS135 2.1 14.5 1.0
N B:NO2704 2.2 32.5 0.0
O2 B:NO2704 2.3 33.2 0.0
O1 B:NO2704 2.4 32.1 0.0
CE1 B:HIS100 2.9 12.1 1.0
CD2 B:HIS135 3.0 14.2 1.0
CE1 C:HIS306 3.1 13.1 1.0
CD2 B:HIS100 3.1 12.4 1.0
CD2 C:HIS306 3.1 13.1 1.0
CE1 B:HIS135 3.2 14.8 1.0
ND2 B:ASN98 4.0 21.3 1.0
ND1 B:HIS100 4.1 12.1 1.0
CG B:HIS100 4.2 12.5 1.0
ND1 C:HIS306 4.2 12.8 1.0
CG B:HIS135 4.2 13.9 1.0
O B:HOH7001 4.2 35.8 1.0
CG C:HIS306 4.2 12.9 1.0
ND1 B:HIS135 4.2 14.3 1.0
NE2 C:HIS255 4.3 15.4 1.0
CE1 C:HIS255 4.4 15.2 1.0
CG B:ASN98 4.5 20.0 1.0
CD2 C:HIS255 4.6 14.9 1.0
OD1 B:ASN98 4.7 21.1 1.0
ND1 C:HIS255 4.8 15.3 1.0
CD1 C:LEU308 5.0 13.4 1.0
CD2 C:LEU308 5.0 12.9 1.0
CG C:HIS255 5.0 14.6 1.0

Copper binding site 5 out of 6 in 1j9q

Go back to Copper Binding Sites List in 1j9q
Copper binding site 5 out of 6 in the Crystal Structure of Nitrite Soaked Oxidized D98N Afnir


Mono view


Stereo pair view

A full contact list of Copper with other atoms in the Cu binding site number 5 of Crystal Structure of Nitrite Soaked Oxidized D98N Afnir within 5.0Å range:
probe atom residue distance (Å) B Occ
C:Cu801

b:20.5
occ:1.00
 ND1 C:HIS145 2.1 17.3 1.0
ND1 C:HIS95 2.1 19.0 1.0
SG C:CYS136 2.3 17.4 1.0
SD C:MET150 2.4 17.3 1.0
CE1 C:HIS145 3.0 17.3 1.0
CE1 C:HIS95 3.0 19.3 1.0
CG C:HIS95 3.1 19.5 1.0
CG C:HIS145 3.1 17.2 1.0
CB C:CYS136 3.2 16.2 1.0
CE C:MET150 3.3 16.9 1.0
CB C:HIS95 3.5 19.4 1.0
CB C:HIS145 3.5 16.6 1.0
CA C:HIS95 3.8 19.6 1.0
CG C:MET150 3.8 16.2 1.0
NE2 C:HIS145 4.1 17.3 1.0
NE2 C:HIS95 4.2 18.7 1.0
CG C:PRO138 4.2 17.6 1.0
CD2 C:HIS145 4.2 17.7 1.0
CD2 C:HIS95 4.2 19.1 1.0
O C:MET94 4.3 20.9 1.0
CB C:MET150 4.4 16.0 1.0
SD C:MET62 4.4 18.5 1.0
CA C:CYS136 4.6 15.9 1.0
N C:ASN96 4.6 18.8 1.0
CD C:PRO138 4.6 17.6 1.0
CB C:MET62 4.7 19.2 1.0
CA C:HIS145 4.8 16.2 1.0
C C:HIS95 4.8 19.4 1.0
N C:HIS95 4.9 20.3 1.0
C C:MET94 5.0 21.2 1.0

Copper binding site 6 out of 6 in 1j9q

Go back to Copper Binding Sites List in 1j9q
Copper binding site 6 out of 6 in the Crystal Structure of Nitrite Soaked Oxidized D98N Afnir


Mono view


Stereo pair view

A full contact list of Copper with other atoms in the Cu binding site number 6 of Crystal Structure of Nitrite Soaked Oxidized D98N Afnir within 5.0Å range:
probe atom residue distance (Å) B Occ
C:Cu802

b:17.0
occ:1.00
 O2 C:NO2804 1.8 30.8 1.0
N C:NO2804 2.0 30.5 1.0
NE2 C:HIS100 2.0 14.8 1.0
NE2 A:HIS306 2.1 13.7 1.0
NE2 C:HIS135 2.1 14.9 1.0
O1 C:NO2804 2.4 30.5 1.0
CE1 C:HIS100 2.9 15.0 1.0
CE1 A:HIS306 3.0 13.1 1.0
CD2 C:HIS135 3.1 14.8 1.0
CE1 C:HIS135 3.1 15.2 1.0
CD2 C:HIS100 3.1 15.1 1.0
CD2 A:HIS306 3.1 13.0 1.0
ND1 C:HIS100 4.0 14.6 1.0
ND1 A:HIS306 4.1 12.9 1.0
CG C:HIS100 4.2 14.9 1.0
ND1 C:HIS135 4.2 14.6 1.0
ND2 C:ASN98 4.2 23.3 1.0
CG C:HIS135 4.2 14.8 1.0
NE2 A:HIS255 4.2 15.3 1.0
CG A:HIS306 4.2 12.3 1.0
CE1 A:HIS255 4.4 15.2 1.0
CD2 A:HIS255 4.6 15.2 1.0
CG C:ASN98 4.8 21.9 1.0
ND1 A:HIS255 4.8 15.1 1.0
CD2 A:LEU308 4.9 12.6 1.0
CG1 A:ILE257 5.0 16.9 1.0
CG A:HIS255 5.0 14.6 1.0
OD1 C:ASN98 5.0 23.3 1.0
CD1 A:LEU308 5.0 12.2 1.0

Reference:

M.J.Boulanger, M.E.Murphy. Alternate Substrate Binding Modes to Two Mutant (D98N and H255N) Forms of Nitrite Reductase From Alcaligenes Faecalis S-6: Structural Model of A Transient Catalytic Intermediate Biochemistry V. 40 9132 2001.
ISSN: ISSN 0006-2960
PubMed: 11478880
DOI: 10.1021/BI0107400
Page generated: Tue Jul 30 22:01:47 2024

Last articles

Zn in 9JYW
Zn in 9IR4
Zn in 9IR3
Zn in 9GMX
Zn in 9GMW
Zn in 9JEJ
Zn in 9ERF
Zn in 9ERE
Zn in 9EGV
Zn in 9EGW
© Copyright 2008-2020 by atomistry.com
Home   |    Site Map   |    Copyright   |    Contact us   |    Privacy