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Potassium in PDB 1nki: Crystal Structure of the Fosfomycin Resistance Protein A (Fosa) Containing Bound Phosphonoformate

Enzymatic activity of Crystal Structure of the Fosfomycin Resistance Protein A (Fosa) Containing Bound Phosphonoformate

All present enzymatic activity of Crystal Structure of the Fosfomycin Resistance Protein A (Fosa) Containing Bound Phosphonoformate:
2.5.1.18;

Protein crystallography data

The structure of Crystal Structure of the Fosfomycin Resistance Protein A (Fosa) Containing Bound Phosphonoformate, PDB code: 1nki was solved by C.L.Rife, R.E.Pharris, M.E.Newcomer, R.N.Armstrong, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 30.00 / 0.95
Space group P 21 21 21
Cell size a, b, c (Å), α, β, γ (°) 54.982, 66.895, 76.723, 90.00, 90.00, 90.00
R / Rfree (%) 14.7 / 17.6

Other elements in 1nki:

The structure of Crystal Structure of the Fosfomycin Resistance Protein A (Fosa) Containing Bound Phosphonoformate also contains other interesting chemical elements:

Manganese (Mn) 2 atoms

Potassium Binding Sites:

The binding sites of Potassium atom in the Crystal Structure of the Fosfomycin Resistance Protein A (Fosa) Containing Bound Phosphonoformate (pdb code 1nki). This binding sites where shown within 5.0 Angstroms radius around Potassium atom.
In total 2 binding sites of Potassium where determined in the Crystal Structure of the Fosfomycin Resistance Protein A (Fosa) Containing Bound Phosphonoformate, PDB code: 1nki:
Jump to Potassium binding site number: 1; 2;

Potassium binding site 1 out of 2 in 1nki

Go back to Potassium Binding Sites List in 1nki
Potassium binding site 1 out of 2 in the Crystal Structure of the Fosfomycin Resistance Protein A (Fosa) Containing Bound Phosphonoformate


Mono view


Stereo pair view

A full contact list of Potassium with other atoms in the K binding site number 1 of Crystal Structure of the Fosfomycin Resistance Protein A (Fosa) Containing Bound Phosphonoformate within 5.0Å range:
probe atom residue distance (Å) B Occ
A:K3002

b:10.9
occ:1.00
OD1 A:ASN92 2.6 12.9 1.0
OG A:SER94 2.7 12.5 1.0
O A:GLY96 2.7 11.9 1.0
O A:HOH9366 2.8 10.7 1.0
OG A:SER98 2.8 10.7 1.0
O A:SER94 3.0 13.2 1.0
O A:GLU95 3.0 11.6 1.0
C A:SER94 3.4 12.9 1.0
CG A:ASN92 3.5 11.5 1.0
CB A:SER98 3.6 9.9 1.0
CE1 A:HIS112 3.6 10.4 1.0
C A:GLU95 3.7 11.9 1.0
NH2 A:ARG119 3.7 12.7 1.0
ND1 A:HIS112 3.7 9.7 1.0
OH A:TYR100 3.8 10.8 1.0
ND2 A:ASN92 3.8 17.1 1.0
CB A:SER94 3.8 13.9 1.0
C A:GLY96 3.9 11.0 1.0
CA A:SER94 3.9 13.8 1.0
N A:SER94 4.1 13.9 1.0
N A:GLU95 4.1 13.7 1.0
O A:HOH9029 4.2 13.2 1.0
N A:GLY96 4.3 11.5 1.0
N A:SER98 4.4 9.5 1.0
OE2 A:GLU110 4.4 9.4 1.0
CA A:GLY96 4.4 11.4 1.0
O2 A:PPF5001 4.5 11.8 1.0
C A:ASP97 4.5 9.6 1.0
CA A:GLU95 4.6 13.4 1.0
CA A:SER98 4.6 9.4 1.0
O A:ASP97 4.6 10.3 1.0
NE2 A:HIS112 4.8 10.1 1.0
CZ A:TYR100 4.8 9.4 1.0
CZ A:ARG119 4.9 11.9 1.0
CB A:ASN92 4.9 11.0 1.0
N A:ASP97 4.9 11.5 1.0
CG A:HIS112 5.0 9.1 1.0

Potassium binding site 2 out of 2 in 1nki

Go back to Potassium Binding Sites List in 1nki
Potassium binding site 2 out of 2 in the Crystal Structure of the Fosfomycin Resistance Protein A (Fosa) Containing Bound Phosphonoformate


Mono view


Stereo pair view

A full contact list of Potassium with other atoms in the K binding site number 2 of Crystal Structure of the Fosfomycin Resistance Protein A (Fosa) Containing Bound Phosphonoformate within 5.0Å range:
probe atom residue distance (Å) B Occ
B:K3001

b:10.6
occ:0.95
OD1 B:ASN92 2.7 12.5 1.0
OG B:SER94 2.7 11.8 1.0
O B:GLY96 2.8 12.2 1.0
O B:HOH9375 2.8 10.8 1.0
OG B:SER98 2.8 10.8 1.0
O B:SER94 2.9 13.1 1.0
O B:GLU95 2.9 11.6 1.0
C B:SER94 3.4 12.2 1.0
CG B:ASN92 3.6 12.1 1.0
CB B:SER98 3.6 10.1 1.0
C B:GLU95 3.7 11.1 1.0
CE1 B:HIS112 3.7 10.4 1.0
OH B:TYR100 3.7 10.7 1.0
NH2 B:ARG119 3.7 12.3 1.0
ND2 B:ASN92 3.8 17.5 1.0
ND1 B:HIS112 3.8 10.2 1.0
CB B:SER94 3.8 12.8 1.0
C B:GLY96 3.9 11.9 1.0
CA B:SER94 3.9 13.0 1.0
N B:SER94 4.1 13.4 1.0
N B:GLU95 4.1 12.6 1.0
O B:HOH9021 4.2 13.1 1.0
N B:GLY96 4.3 12.0 1.0
OE2 B:GLU110 4.4 9.6 1.0
N B:SER98 4.5 9.9 1.0
CA B:GLY96 4.5 12.0 1.0
O2 B:PPF5002 4.5 11.7 1.0
CA B:GLU95 4.5 11.6 1.0
C B:ASP97 4.5 10.8 1.0
CA B:SER98 4.6 9.8 1.0
O B:ASP97 4.7 10.7 1.0
CZ B:TYR100 4.8 9.5 1.0
NE2 B:HIS112 4.8 9.8 1.0
O B:HOH9357 4.9 44.1 1.0
CZ B:ARG119 4.9 10.7 1.0
CB B:ASN92 4.9 11.6 1.0
CE1 B:TYR100 5.0 9.7 1.0
N B:ASP97 5.0 12.2 1.0
O1 B:PPF5002 5.0 10.0 1.0

Reference:

R.E.Rigsby, C.L.Rife, K.L.Fillgrove, M.E.Newcomer, R.N.Armstrong. Phosphonoformate: A Minimal Transition State Analogue Inhibitor of the Fosfomycin Resistance Protein, Fosa. Biochemistry V. 43 13666 2004.
ISSN: ISSN 0006-2960
PubMed: 15504029
DOI: 10.1021/BI048767H
Page generated: Mon Aug 12 05:03:14 2024

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