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Potassium in PDB 3a45: Crystal Structure of MVNEI1_2

Enzymatic activity of Crystal Structure of MVNEI1_2

All present enzymatic activity of Crystal Structure of MVNEI1_2:
3.2.2.23;

Protein crystallography data

The structure of Crystal Structure of MVNEI1_2, PDB code: 3a45 was solved by K.Imamura, S.Wallace, S.Doublie, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 15.00 / 2.30
Space group P 1
Cell size a, b, c (Å), α, β, γ (°) 38.673, 54.417, 87.308, 107.00, 99.86, 93.42
R / Rfree (%) 20.3 / 26.5

Potassium Binding Sites:

The binding sites of Potassium atom in the Crystal Structure of MVNEI1_2 (pdb code 3a45). 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 MVNEI1_2, PDB code: 3a45:
Jump to Potassium binding site number: 1; 2;

Potassium binding site 1 out of 2 in 3a45

Go back to Potassium Binding Sites List in 3a45
Potassium binding site 1 out of 2 in the Crystal Structure of MVNEI1_2


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 MVNEI1_2 within 5.0Å range:
probe atom residue distance (Å) B Occ
A:K290

b:29.5
occ:1.00
OG A:SER73 2.8 15.4 1.0
O B:PHE119 2.8 9.5 1.0
N B:GLU39 2.9 11.6 1.0
OD1 A:ASP71 2.9 15.1 1.0
CB A:SER73 3.3 12.2 1.0
O A:HOH1022 3.5 20.3 1.0
CA B:PRO38 3.5 12.7 1.0
CB B:GLU39 3.5 12.3 1.0
O B:HOH1023 3.6 16.8 1.0
CB B:PRO38 3.7 11.0 1.0
C B:PRO38 3.7 12.4 1.0
CG A:ASP71 3.7 15.2 1.0
CA B:GLU39 3.8 10.5 1.0
OD2 A:ASP71 3.9 12.3 1.0
C B:PHE119 3.9 8.0 1.0
CA B:LYS120 4.1 4.1 1.0
CB B:LYS120 4.1 6.3 1.0
N A:SER73 4.3 14.3 1.0
CE1 B:TYR33 4.3 7.3 1.0
CA A:SER73 4.4 15.5 1.0
N B:LYS120 4.5 4.8 1.0
OH B:TYR33 4.6 7.3 1.0
CG B:PRO38 4.8 9.7 1.0
CZ B:TYR33 4.8 6.2 1.0
O A:HOH1042 4.8 17.0 1.0
O B:GLU39 4.8 8.8 1.0
C B:GLU39 4.9 9.0 1.0
CG B:LYS120 4.9 7.8 1.0
N B:PRO38 4.9 13.4 1.0
CG A:LYS72 4.9 23.9 1.0
O B:PRO38 4.9 11.6 1.0
CG B:GLU39 5.0 12.5 1.0

Potassium binding site 2 out of 2 in 3a45

Go back to Potassium Binding Sites List in 3a45
Potassium binding site 2 out of 2 in the Crystal Structure of MVNEI1_2


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 MVNEI1_2 within 5.0Å range:
probe atom residue distance (Å) B Occ
B:K290

b:32.5
occ:1.00
O B:SER30 2.7 6.5 1.0
N B:TYR33 2.8 9.3 1.0
O B:HOH1003 2.8 5.1 1.0
N B:ARG32 3.4 10.0 1.0
CB B:TYR33 3.4 7.7 1.0
CD2 B:TYR33 3.5 3.6 1.0
CA B:TYR33 3.5 9.6 1.0
C B:GLY31 3.5 10.5 1.0
CA B:GLY31 3.7 9.8 1.0
CB B:ARG97 3.8 6.0 1.0
CG B:TYR33 3.8 7.8 1.0
C B:SER30 3.8 9.6 1.0
C B:ARG32 3.8 10.7 1.0
N B:SER34 4.0 12.4 1.0
CD2 B:PHE28 4.0 4.3 1.0
CA B:ARG32 4.0 10.8 1.0
CG B:ARG32 4.1 16.6 1.0
C B:TYR33 4.1 12.0 1.0
O B:GLY31 4.1 10.8 1.0
N B:GLY31 4.3 11.3 1.0
CG B:ARG97 4.4 6.4 1.0
O B:ARG97 4.5 5.0 1.0
CE2 B:TYR33 4.6 5.7 1.0
CD B:ARG97 4.6 5.8 1.0
CB B:ARG32 4.6 12.1 1.0
CB B:PHE28 4.7 4.4 1.0
CA B:ARG97 4.7 5.1 1.0
OD1 B:ASN115 4.7 13.7 1.0
CG B:PHE28 4.7 7.9 1.0
CE2 B:PHE28 4.8 7.9 1.0
C B:ARG97 4.8 5.6 1.0
O B:HOH1007 5.0 15.3 1.0
O B:ARG32 5.0 13.0 1.0

Reference:

K.Imamura, S.S.Wallace, S.Doublie. Structural Characterization of A Viral NEIL1 Ortholog Unliganded and Bound to Abasic Site-Containing Dna J.Biol.Chem. V. 284 26174 2009.
ISSN: ISSN 0021-9258
PubMed: 19625256
DOI: 10.1074/JBC.M109.021907
Page generated: Mon Aug 12 07:47:19 2024

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