Atomistry » Molybdenum » PDB 1aa6-1n61 » 1jrp
Atomistry »
  Molybdenum »
    PDB 1aa6-1n61 »
      1jrp »

Molybdenum in PDB 1jrp: Crystal Structure of Xanthine Dehydrogenase Inhibited By Alloxanthine From Rhodobacter Capsulatus

Enzymatic activity of Crystal Structure of Xanthine Dehydrogenase Inhibited By Alloxanthine From Rhodobacter Capsulatus

All present enzymatic activity of Crystal Structure of Xanthine Dehydrogenase Inhibited By Alloxanthine From Rhodobacter Capsulatus:
1.1.1.204;

Protein crystallography data

The structure of Crystal Structure of Xanthine Dehydrogenase Inhibited By Alloxanthine From Rhodobacter Capsulatus, PDB code: 1jrp was solved by J.J.Truglio, K.Theis, S.Leimkuhler, R.Rappa, K.V.Rajagopalan, C.Kisker, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 30.00 / 3.00
Space group P 1
Cell size a, b, c (Å), α, β, γ (°) 92.617, 140.728, 157.665, 109.59, 105.84, 101.25
R / Rfree (%) 19.3 / 24.3

Other elements in 1jrp:

The structure of Crystal Structure of Xanthine Dehydrogenase Inhibited By Alloxanthine From Rhodobacter Capsulatus also contains other interesting chemical elements:

Iron (Fe) 16 atoms
Calcium (Ca) 4 atoms

Molybdenum Binding Sites:

The binding sites of Molybdenum atom in the Crystal Structure of Xanthine Dehydrogenase Inhibited By Alloxanthine From Rhodobacter Capsulatus (pdb code 1jrp). This binding sites where shown within 5.0 Angstroms radius around Molybdenum atom.
In total 4 binding sites of Molybdenum where determined in the Crystal Structure of Xanthine Dehydrogenase Inhibited By Alloxanthine From Rhodobacter Capsulatus, PDB code: 1jrp:
Jump to Molybdenum binding site number: 1; 2; 3; 4;

Molybdenum binding site 1 out of 4 in 1jrp

Go back to Molybdenum Binding Sites List in 1jrp
Molybdenum binding site 1 out of 4 in the Crystal Structure of Xanthine Dehydrogenase Inhibited By Alloxanthine From Rhodobacter Capsulatus


Mono view


Stereo pair view

A full contact list of Molybdenum with other atoms in the Mo binding site number 1 of Crystal Structure of Xanthine Dehydrogenase Inhibited By Alloxanthine From Rhodobacter Capsulatus within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Mo3004

b:29.8
occ:0.70
 MO B:MOS3004 0.0 29.8 0.7
O2 B:MOS3004 1.7 16.3 0.7
S B:MOS3004 2.0 25.3 0.7
N8 B:1414000 2.1 23.1 0.7
S2' B:MTE3003 2.2 13.3 0.7
S1' B:MTE3003 2.2 12.4 0.7
OE2 B:GLU730 3.1 16.2 1.0
N9 B:1414000 3.1 24.4 0.7
C7 B:1414000 3.1 25.5 0.7
C1' B:MTE3003 3.3 16.3 0.7
C2' B:MTE3003 3.4 15.4 0.7
CD B:GLU730 3.9 19.8 1.0
N B:ALA529 3.9 29.5 1.0
CB B:ALA528 4.2 27.4 1.0
C4 B:1414000 4.3 25.5 0.7
C5 B:1414000 4.3 24.6 0.7
CA B:GLY229 4.3 21.1 1.0
N B:ARG342 4.4 21.9 1.0
CA B:ALA528 4.4 26.7 1.0
N B:GLY229 4.4 20.7 1.0
CA B:ARG342 4.4 22.0 1.0
OE1 B:GLU730 4.6 23.2 1.0
C6 B:MTE3003 4.6 16.4 0.7
CG B:GLU730 4.7 21.8 1.0
C B:ALA528 4.7 28.7 1.0
C B:PHE228 4.9 20.4 1.0
CA B:ALA529 4.9 29.8 1.0
NE2 B:GLN197 4.9 15.3 1.0
N B:GLY343 5.0 21.0 1.0
C B:PHE341 5.0 21.8 1.0
C3' B:MTE3003 5.0 19.6 0.7

Molybdenum binding site 2 out of 4 in 1jrp

Go back to Molybdenum Binding Sites List in 1jrp
Molybdenum binding site 2 out of 4 in the Crystal Structure of Xanthine Dehydrogenase Inhibited By Alloxanthine From Rhodobacter Capsulatus


Mono view


Stereo pair view

A full contact list of Molybdenum with other atoms in the Mo binding site number 2 of Crystal Structure of Xanthine Dehydrogenase Inhibited By Alloxanthine From Rhodobacter Capsulatus within 5.0Å range:
probe atom residue distance (Å) B Occ
D:Mo3004

b:23.5
occ:0.70
 MO D:MOS3004 0.0 23.5 0.7
O2 D:MOS3004 1.7 13.0 0.7
S D:MOS3004 2.0 16.3 0.7
S1' D:MTE3003 2.1 7.9 0.7
N8 D:1414000 2.1 28.1 0.7
S2' D:MTE3003 2.2 7.2 0.7
OE2 D:GLU730 2.7 20.0 1.0
N9 D:1414000 3.1 29.3 0.7
C7 D:1414000 3.2 27.4 0.7
C1' D:MTE3003 3.3 10.7 0.7
C2' D:MTE3003 3.4 9.5 0.7
CD D:GLU730 3.8 24.4 1.0
N D:ALA529 3.9 27.4 1.0
C4 D:1414000 4.3 25.9 0.7
CA D:GLY229 4.3 18.1 1.0
N D:ARG342 4.4 18.9 1.0
CB D:ALA528 4.4 23.8 1.0
CA D:ALA528 4.4 23.0 1.0
C5 D:1414000 4.4 26.3 0.7
CA D:ARG342 4.4 19.4 1.0
N D:GLY229 4.5 17.4 1.0
CG D:GLU730 4.5 23.8 1.0
C6 D:MTE3003 4.6 9.7 0.7
C D:ALA528 4.7 25.3 1.0
OE1 D:GLU730 4.8 29.1 1.0
C D:PHE228 4.8 16.6 1.0
O D:PHE228 4.8 18.3 1.0
OE2 D:GLU232 4.9 32.0 1.0
C D:PHE341 4.9 19.4 1.0
CA D:ALA529 4.9 29.3 1.0
C3' D:MTE3003 5.0 12.5 0.7

Molybdenum binding site 3 out of 4 in 1jrp

Go back to Molybdenum Binding Sites List in 1jrp
Molybdenum binding site 3 out of 4 in the Crystal Structure of Xanthine Dehydrogenase Inhibited By Alloxanthine From Rhodobacter Capsulatus


Mono view


Stereo pair view

A full contact list of Molybdenum with other atoms in the Mo binding site number 3 of Crystal Structure of Xanthine Dehydrogenase Inhibited By Alloxanthine From Rhodobacter Capsulatus within 5.0Å range:
probe atom residue distance (Å) B Occ
F:Mo3004

b:28.7
occ:0.70
 MO F:MOS3004 0.0 28.7 0.7
O2 F:MOS3004 1.7 21.3 0.7
N8 F:1414000 1.8 24.7 0.7
S F:MOS3004 2.0 25.9 0.7
S1' F:MTE3003 2.0 5.8 0.7
S2' F:MTE3003 2.2 16.1 0.7
OE2 F:GLU730 2.5 34.1 1.0
N9 F:1414000 2.7 27.4 0.7
C7 F:1414000 2.9 24.9 0.7
C1' F:MTE3003 3.2 10.3 0.7
C2' F:MTE3003 3.5 11.8 0.7
CD F:GLU730 3.6 33.4 1.0
N F:ALA529 3.9 29.1 1.0
C4 F:1414000 4.0 26.8 0.7
C5 F:1414000 4.1 25.9 0.7
CB F:ALA528 4.3 25.9 1.0
CA F:GLY229 4.3 21.4 1.0
OE1 F:GLU730 4.3 39.3 1.0
CA F:ALA528 4.4 25.5 1.0
CG F:GLU730 4.4 27.2 1.0
N F:ARG342 4.5 21.8 1.0
N F:GLY229 4.5 21.0 1.0
CA F:ARG342 4.5 21.5 1.0
C6 F:MTE3003 4.6 12.0 0.7
C F:ALA528 4.7 27.2 1.0
C F:PHE228 4.8 21.0 1.0
NE2 F:GLN197 4.9 14.8 1.0
O F:PHE228 4.9 23.0 1.0
CA F:ALA529 4.9 30.9 1.0
C F:PHE341 5.0 22.6 1.0

Molybdenum binding site 4 out of 4 in 1jrp

Go back to Molybdenum Binding Sites List in 1jrp
Molybdenum binding site 4 out of 4 in the Crystal Structure of Xanthine Dehydrogenase Inhibited By Alloxanthine From Rhodobacter Capsulatus


Mono view


Stereo pair view

A full contact list of Molybdenum with other atoms in the Mo binding site number 4 of Crystal Structure of Xanthine Dehydrogenase Inhibited By Alloxanthine From Rhodobacter Capsulatus within 5.0Å range:
probe atom residue distance (Å) B Occ
H:Mo3004

b:36.3
occ:0.70
 MO H:MOS3004 0.0 36.3 0.7
O2 H:MOS3004 1.7 27.9 0.7
N8 H:1414000 1.9 22.7 0.7
S H:MOS3004 2.1 29.0 0.7
S2' H:MTE3003 2.3 24.9 0.7
S1' H:MTE3003 2.4 9.0 0.7
C7 H:1414000 2.8 24.8 0.7
OE2 H:GLU730 3.0 25.5 1.0
N9 H:1414000 3.0 24.4 0.7
C1' H:MTE3003 3.5 17.2 0.7
C2' H:MTE3003 3.6 20.0 0.7
N H:ALA529 3.9 31.1 1.0
CD H:GLU730 4.0 26.4 1.0
CB H:ALA528 4.0 29.1 1.0
C5 H:1414000 4.1 25.4 0.7
C4 H:1414000 4.1 25.7 0.7
CA H:GLY229 4.2 24.4 1.0
CA H:ALA528 4.3 27.9 1.0
N H:ARG342 4.3 24.6 1.0
CA H:ARG342 4.4 24.4 1.0
N H:GLY229 4.5 23.5 1.0
OE1 H:GLU730 4.6 26.0 1.0
C H:ALA528 4.7 29.8 1.0
C6 H:MTE3003 4.8 18.2 0.7
OE2 H:GLU232 4.8 27.4 1.0
CG H:GLU730 4.8 28.9 1.0
C H:PHE228 4.8 23.2 1.0
O H:PHE228 4.9 24.0 1.0
CA H:ALA529 4.9 31.7 1.0
C H:PHE341 5.0 24.9 1.0
NE2 H:GLN197 5.0 22.5 1.0
CD1 H:PHE344 5.0 24.3 1.0

Reference:

J.J.Truglio, K.Theis, S.Leimkuhler, R.Rappa, K.V.Rajagopalan, C.Kisker. Crystal Structures of the Active and Alloxanthine-Inhibited Forms of Xanthine Dehydrogenase From Rhodobacter Capsulatus Structure V. 10 115 2002.
ISSN: ISSN 0969-2126
PubMed: 11796116
DOI: 10.1016/S0969-2126(01)00697-9
Page generated: Sun Oct 6 15:22:44 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