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Potassium in PDB 5vnv: Crystal Structure of Nb.B201

Protein crystallography data

The structure of Crystal Structure of Nb.B201, PDB code: 5vnv was solved by A.C.Kruse, C.Mcmahon, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 46.90 / 1.40
Space group I 41 2 2
Cell size a, b, c (Å), α, β, γ (°) 106.751, 106.751, 52.232, 90.00, 90.00, 90.00
R / Rfree (%) 18.3 / 21.4

Potassium Binding Sites:

The binding sites of Potassium atom in the Crystal Structure of Nb.B201 (pdb code 5vnv). This binding sites where shown within 5.0 Angstroms radius around Potassium atom.
In total 4 binding sites of Potassium where determined in the Crystal Structure of Nb.B201, PDB code: 5vnv:
Jump to Potassium binding site number: 1; 2; 3; 4;

Potassium binding site 1 out of 4 in 5vnv

Go back to Potassium Binding Sites List in 5vnv
Potassium binding site 1 out of 4 in the Crystal Structure of Nb.B201


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 Nb.B201 within 5.0Å range:
probe atom residue distance (Å) B Occ
A:K204

b:17.9
occ:1.00
O A:ASN73 2.6 18.1 1.0
OD1 A:ASN76 2.7 17.7 1.0
O A:HOH327 2.7 22.9 1.0
O A:HOH378 2.8 24.5 1.0
O A:ILE28 2.8 18.4 1.0
O A:HOH332 3.1 19.8 1.0
CE1 A:TYR27 3.2 21.0 1.0
CD1 A:TYR27 3.4 20.7 1.0
CG A:ASN76 3.7 17.0 1.0
C A:ASN73 3.7 15.4 1.0
OD1 A:ASP30 3.7 20.2 1.0
C A:ILE28 3.9 18.7 1.0
N A:ILE28 4.1 16.6 1.0
CZ A:TYR27 4.2 21.4 1.0
ND2 A:ASN76 4.3 21.0 1.0
O A:HOH387 4.5 18.2 1.0
CA A:ASN73 4.5 15.4 1.0
CG A:TYR27 4.5 19.6 1.0
CA A:ILE28 4.5 17.0 1.0
O A:HOH417 4.6 30.2 1.0
N A:ALA74 4.7 15.4 1.0
N A:ASN76 4.7 16.4 1.0
O A:ALA74 4.7 20.6 1.0
CA A:ALA74 4.7 16.9 1.0
OH A:TYR27 4.7 26.5 1.0
CA A:ASN76 4.8 15.9 1.0
C A:ALA74 4.8 17.5 1.0
CB A:ASN76 4.8 16.1 1.0
CB A:ASN73 4.8 16.6 1.0
CG A:ASP30 4.8 22.1 1.0
CB A:ILE28 4.9 16.1 1.0
N A:SER29 5.0 16.8 1.0
C A:TYR27 5.0 18.0 1.0
CA A:TYR27 5.0 18.6 1.0

Potassium binding site 2 out of 4 in 5vnv

Go back to Potassium Binding Sites List in 5vnv
Potassium binding site 2 out of 4 in the Crystal Structure of Nb.B201


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 Nb.B201 within 5.0Å range:
probe atom residue distance (Å) B Occ
A:K205

b:23.5
occ:0.44
O A:THR57 2.6 15.5 1.0
O A:HOH358 2.7 22.3 1.0
O A:HOH303 3.6 49.2 1.0
C A:THR57 3.7 13.4 1.0
OG1 A:THR57 3.9 15.9 1.0
O1 A:FMT208 4.0 21.1 1.0
O2 A:FMT208 4.1 26.3 1.0
N A:THR57 4.4 14.1 1.0
C A:FMT208 4.5 25.0 1.0
CA A:THR57 4.5 12.9 1.0
N A:TYR58 4.6 12.9 1.0
CA A:TYR58 4.7 13.2 1.0
O A:HOH406 4.7 40.3 1.0
CB A:THR57 4.9 14.7 1.0
O A:HOH330 4.9 19.9 1.0
CD1 A:TYR58 5.0 15.4 1.0

Potassium binding site 3 out of 4 in 5vnv

Go back to Potassium Binding Sites List in 5vnv
Potassium binding site 3 out of 4 in the Crystal Structure of Nb.B201


Mono view


Stereo pair view

A full contact list of Potassium with other atoms in the K binding site number 3 of Crystal Structure of Nb.B201 within 5.0Å range:
probe atom residue distance (Å) B Occ
A:K206

b:44.3
occ:1.00
O A:GLU120 2.6 34.7 1.0
OE1 A:GLN13 3.0 39.3 1.0
C A:GLU120 3.2 43.3 1.0
CA A:GLU120 3.3 50.7 1.0
CD A:GLN13 3.7 33.2 1.0
CB A:GLU120 3.7 56.0 1.0
NE2 A:GLN13 4.1 29.4 1.0
O A:LEU119 4.7 35.6 1.0
N A:GLU120 4.7 50.0 1.0
CG A:GLN13 4.8 28.0 1.0

Potassium binding site 4 out of 4 in 5vnv

Go back to Potassium Binding Sites List in 5vnv
Potassium binding site 4 out of 4 in the Crystal Structure of Nb.B201


Mono view


Stereo pair view

A full contact list of Potassium with other atoms in the K binding site number 4 of Crystal Structure of Nb.B201 within 5.0Å range:
probe atom residue distance (Å) B Occ
A:K207

b:22.1
occ:1.00
O A:HIS53 2.7 16.1 1.0
OG1 A:THR55 2.7 15.5 1.0
O A:HOH414 2.8 35.0 1.0
OD1 A:ASN56 2.9 18.8 1.0
C A:HIS53 3.9 14.5 1.0
CG A:ASN56 3.9 16.2 1.0
CB A:THR55 4.0 14.7 1.0
N A:THR55 4.1 12.6 1.0
CB A:HIS53 4.1 15.4 1.0
ND2 A:ASN56 4.3 16.6 1.0
CG2 A:THR55 4.4 17.2 1.0
CA A:THR55 4.5 14.2 1.0
N A:ASN56 4.6 13.9 1.0
CA A:HIS53 4.7 13.2 1.0
C A:THR55 4.7 15.7 1.0
O A:HOH390 4.8 33.8 1.0
N A:GLY54 4.9 14.3 1.0

Reference:

C.Mcmahon, A.S.Baier, R.Pascolutti, M.Wegrecki, S.Zheng, J.X.Ong, S.C.Erlandson, D.Hilger, S.G.F.Rasmussen, A.M.Ring, A.Manglik, A.C.Kruse. Yeast Surface Display Platform For Rapid Discovery of Conformationally Selective Nanobodies. Nat. Struct. Mol. Biol. V. 25 289 2018.
ISSN: ESSN 1545-9985
PubMed: 29434346
DOI: 10.1038/S41594-018-0028-6
Page generated: Mon Aug 12 14:51:12 2024

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