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Manganese in PDB 2wod: Crystal Structure of the Dinitrogenase Reductase-Activating Glycohydrolase (Drag) From Rhodospirillum Rubrum in Complex with Adp- Ribsoyllysine

Enzymatic activity of Crystal Structure of the Dinitrogenase Reductase-Activating Glycohydrolase (Drag) From Rhodospirillum Rubrum in Complex with Adp- Ribsoyllysine

All present enzymatic activity of Crystal Structure of the Dinitrogenase Reductase-Activating Glycohydrolase (Drag) From Rhodospirillum Rubrum in Complex with Adp- Ribsoyllysine:
3.2.2.24;

Protein crystallography data

The structure of Crystal Structure of the Dinitrogenase Reductase-Activating Glycohydrolase (Drag) From Rhodospirillum Rubrum in Complex with Adp- Ribsoyllysine, PDB code: 2wod was solved by C.L.Berthold, H.Wang, S.Nordlund, M.Hogbom, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 34.92 / 2.25
Space group P 31 2 1
Cell size a, b, c (Å), α, β, γ (°) 77.306, 77.306, 245.593, 90.00, 90.00, 120.00
R / Rfree (%) 19.7 / 24.2

Other elements in 2wod:

The structure of Crystal Structure of the Dinitrogenase Reductase-Activating Glycohydrolase (Drag) From Rhodospirillum Rubrum in Complex with Adp- Ribsoyllysine also contains other interesting chemical elements:

Chlorine (Cl) 1 atom

Manganese Binding Sites:

The binding sites of Manganese atom in the Crystal Structure of the Dinitrogenase Reductase-Activating Glycohydrolase (Drag) From Rhodospirillum Rubrum in Complex with Adp- Ribsoyllysine (pdb code 2wod). This binding sites where shown within 5.0 Angstroms radius around Manganese atom.
In total 2 binding sites of Manganese where determined in the Crystal Structure of the Dinitrogenase Reductase-Activating Glycohydrolase (Drag) From Rhodospirillum Rubrum in Complex with Adp- Ribsoyllysine, PDB code: 2wod:
Jump to Manganese binding site number: 1; 2;

Manganese binding site 1 out of 2 in 2wod

Go back to Manganese Binding Sites List in 2wod
Manganese binding site 1 out of 2 in the Crystal Structure of the Dinitrogenase Reductase-Activating Glycohydrolase (Drag) From Rhodospirillum Rubrum in Complex with Adp- Ribsoyllysine


Mono view


Stereo pair view

A full contact list of Manganese with other atoms in the Mn binding site number 1 of Crystal Structure of the Dinitrogenase Reductase-Activating Glycohydrolase (Drag) From Rhodospirillum Rubrum in Complex with Adp- Ribsoyllysine within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Mn400

b:41.9
occ:0.50
O A:HOH2034 2.6 46.3 1.0
OD1 A:ASP243 2.6 50.2 1.0
O4'A A:ZZC401 2.6 33.0 1.0
OG1 A:THR246 2.8 42.7 1.0
O3'A A:ZZC401 2.8 35.1 1.0
OD2 A:ASP243 2.8 47.6 1.0
O A:HOH2010 3.0 37.2 1.0
CG A:ASP243 3.1 45.0 1.0
OD2 A:ASP61 3.4 46.1 1.0
O A:HOH2099 3.4 41.7 1.0
C4'A A:ZZC401 3.5 34.0 1.0
C3'A A:ZZC401 3.7 33.4 1.0
CB A:THR246 4.0 43.0 1.0
CB A:ASP245 4.1 43.1 1.0
OE1 A:GLU28 4.1 51.6 1.0
N A:THR246 4.3 42.8 1.0
CG A:ASP61 4.3 45.5 1.0
C2'A A:ZZC401 4.3 35.0 1.0
OD1 A:ASN126 4.5 40.2 1.0
OD1 A:ASP61 4.5 48.5 1.0
OD1 A:ASP60 4.6 45.8 1.0
CB A:ASP243 4.6 44.0 1.0
CA A:THR246 4.7 43.0 1.0
SD A:MET130 4.8 41.4 1.0
OD2 A:ASP60 4.8 43.3 1.0
C1'A A:ZZC401 4.8 33.9 1.0
O2'A A:ZZC401 4.9 32.9 1.0
C5'A A:ZZC401 4.9 34.0 1.0
C A:ASP245 5.0 43.1 1.0
OD2 A:ASP245 5.0 46.2 1.0

Manganese binding site 2 out of 2 in 2wod

Go back to Manganese Binding Sites List in 2wod
Manganese binding site 2 out of 2 in the Crystal Structure of the Dinitrogenase Reductase-Activating Glycohydrolase (Drag) From Rhodospirillum Rubrum in Complex with Adp- Ribsoyllysine


Mono view


Stereo pair view

A full contact list of Manganese with other atoms in the Mn binding site number 2 of Crystal Structure of the Dinitrogenase Reductase-Activating Glycohydrolase (Drag) From Rhodospirillum Rubrum in Complex with Adp- Ribsoyllysine within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Mn400

b:36.9
occ:0.50
OD2 B:ASP245 2.5 49.8 1.0
OG1 B:THR246 2.5 44.4 1.0
O4'A B:ZZC401 2.5 50.2 1.0
OD1 B:ASP243 2.6 46.8 1.0
OD1 B:ASP245 2.6 51.6 1.0
OD2 B:ASP243 2.7 43.8 1.0
CG B:ASP245 2.9 46.6 1.0
CG B:ASP243 3.0 43.9 1.0
O3'A B:ZZC401 3.3 52.4 1.0
C4'A B:ZZC401 3.6 51.3 1.0
OE2 B:GLU28 3.6 54.0 1.0
CB B:THR246 3.7 42.8 1.0
C3'A B:ZZC401 3.8 53.2 1.0
O B:HOH2033 3.9 49.3 1.0
C2'A B:ZZC401 4.1 55.9 1.0
N B:THR246 4.2 42.7 1.0
O2'A B:ZZC401 4.2 59.1 1.0
OD2 B:ASP61 4.2 43.0 1.0
CB B:ASP245 4.4 43.7 1.0
OD1 B:ASP61 4.4 45.0 1.0
CD B:GLU28 4.4 51.1 1.0
CB B:ASP243 4.4 43.3 1.0
CA B:THR246 4.5 42.7 1.0
OD1 B:ASN126 4.6 42.7 1.0
CG B:ASP61 4.7 44.1 1.0
CG2 B:THR246 4.8 41.8 1.0
ND2 B:ASN126 4.8 39.4 1.0
OD1 B:ASP60 4.8 46.3 1.0
C5'A B:ZZC401 4.9 49.8 1.0
C B:ASP245 4.9 42.4 1.0
O B:ASP243 5.0 43.5 1.0
C1'A B:ZZC401 5.0 55.9 1.0

Reference:

C.L.Berthold, H.Wang, S.Nordlund, M.Hogbom. Mechanism of Adp-Ribosylation Removal Revealed By the Structure and Ligand Complexes of the Dimanganese Mono-Adp-Ribosylhydrolase Drag. Proc.Natl.Acad.Sci.Usa V. 106 14247 2009.
ISSN: ISSN 0027-8424
PubMed: 19706507
DOI: 10.1073/PNAS.0905906106
Page generated: Sat Oct 5 15:23:53 2024

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