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Potassium in PDB 4a1o: Crystal Structure of Mycobacterium Tuberculosis Purh Complexed with Aicar and A Novel Nucleotide Cfair, at 2.48 A Resolution.

Enzymatic activity of Crystal Structure of Mycobacterium Tuberculosis Purh Complexed with Aicar and A Novel Nucleotide Cfair, at 2.48 A Resolution.

All present enzymatic activity of Crystal Structure of Mycobacterium Tuberculosis Purh Complexed with Aicar and A Novel Nucleotide Cfair, at 2.48 A Resolution.:
2.1.2.3; 3.5.4.10;

Protein crystallography data

The structure of Crystal Structure of Mycobacterium Tuberculosis Purh Complexed with Aicar and A Novel Nucleotide Cfair, at 2.48 A Resolution., PDB code: 4a1o was solved by J.Le Nours, E.M.M.Bulloch, Z.Zhang, D.R.Greenwood, M.J.Middleditch, J.M.J.Dickson, E.N.Baker, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 43.84 / 2.48
Space group P 21 21 21
Cell size a, b, c (Å), α, β, γ (°) 75.258, 107.883, 130.924, 90.00, 90.00, 90.00
R / Rfree (%) 18.2 / 22.71

Potassium Binding Sites:

The binding sites of Potassium atom in the Crystal Structure of Mycobacterium Tuberculosis Purh Complexed with Aicar and A Novel Nucleotide Cfair, at 2.48 A Resolution. (pdb code 4a1o). 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 Mycobacterium Tuberculosis Purh Complexed with Aicar and A Novel Nucleotide Cfair, at 2.48 A Resolution., PDB code: 4a1o:
Jump to Potassium binding site number: 1; 2;

Potassium binding site 1 out of 2 in 4a1o

Go back to Potassium Binding Sites List in 4a1o
Potassium binding site 1 out of 2 in the Crystal Structure of Mycobacterium Tuberculosis Purh Complexed with Aicar and A Novel Nucleotide Cfair, at 2.48 A Resolution.


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 Mycobacterium Tuberculosis Purh Complexed with Aicar and A Novel Nucleotide Cfair, at 2.48 A Resolution. within 5.0Å range:
probe atom residue distance (Å) B Occ
A:K1524

b:39.0
occ:1.00
O A:VAL424 2.5 36.2 1.0
O A:HIS520 2.6 40.2 1.0
O A:CYS421 2.6 44.0 0.5
O A:CYS421 2.6 44.5 0.5
OD2 A:ASP470 2.7 40.0 1.0
O A:ARG422 2.8 44.5 1.0
C A:ARG422 3.5 43.3 1.0
CG A:ASP470 3.6 37.5 1.0
N A:ALA522 3.6 33.1 1.0
CB A:ASP470 3.7 34.8 1.0
C A:CYS421 3.7 44.7 0.5
C A:CYS421 3.7 44.2 0.5
C A:VAL424 3.7 36.7 1.0
C A:HIS520 3.8 40.0 1.0
CA A:ARG422 3.8 40.0 1.0
CB A:ALA522 3.8 33.3 1.0
C A:PHE521 3.8 38.1 1.0
OG A:SER426 3.9 34.7 1.0
CA A:PHE521 4.0 35.8 1.0
N A:VAL424 4.1 35.2 1.0
N A:ARG422 4.2 41.1 1.0
CB A:ALA428 4.2 35.4 1.0
CA A:ALA522 4.3 33.1 1.0
N A:PHE521 4.4 37.2 1.0
CA A:VAL424 4.4 34.0 1.0
O A:PHE521 4.5 38.9 1.0
N A:ALA423 4.5 38.2 1.0
N A:SER426 4.6 32.6 1.0
O A:ALA522 4.7 39.5 1.0
OD1 A:ASP470 4.7 37.2 1.0
C A:ALA423 4.7 40.5 1.0
N A:LYS425 4.8 32.8 1.0
C A:LYS425 4.8 36.8 1.0
CB A:VAL424 4.8 36.7 1.0
CA A:LYS425 4.9 32.6 1.0
CB A:HIS520 4.9 36.0 1.0
CA A:CYS421 5.0 40.4 0.5
CA A:CYS421 5.0 39.0 0.5
CA A:HIS520 5.0 35.8 1.0

Potassium binding site 2 out of 2 in 4a1o

Go back to Potassium Binding Sites List in 4a1o
Potassium binding site 2 out of 2 in the Crystal Structure of Mycobacterium Tuberculosis Purh Complexed with Aicar and A Novel Nucleotide Cfair, at 2.48 A Resolution.


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 Mycobacterium Tuberculosis Purh Complexed with Aicar and A Novel Nucleotide Cfair, at 2.48 A Resolution. within 5.0Å range:
probe atom residue distance (Å) B Occ
B:K1524

b:34.7
occ:1.00
O B:VAL424 2.5 35.5 1.0
O B:HIS520 2.6 34.6 1.0
O B:CYS421 2.6 38.8 0.5
O B:CYS421 2.6 38.2 0.5
OD2 B:ASP470 2.7 39.8 1.0
O B:ARG422 2.8 37.5 1.0
C B:ARG422 3.5 37.7 1.0
CG B:ASP470 3.6 40.5 1.0
N B:ALA522 3.6 34.9 1.0
CB B:ASP470 3.6 34.0 1.0
C B:CYS421 3.7 39.4 0.5
C B:CYS421 3.7 38.8 0.5
C B:VAL424 3.7 35.8 1.0
C B:HIS520 3.8 35.8 1.0
CA B:ARG422 3.8 34.7 1.0
CB B:ALA522 3.8 34.4 1.0
OG B:SER426 3.8 29.2 1.0
C B:PHE521 3.9 36.5 1.0
CA B:PHE521 4.1 31.2 1.0
N B:VAL424 4.1 34.6 1.0
N B:ARG422 4.2 35.0 1.0
CB B:ALA428 4.2 32.5 1.0
CA B:ALA522 4.3 34.8 1.0
N B:PHE521 4.4 32.2 1.0
CA B:VAL424 4.4 33.6 1.0
O B:PHE521 4.5 37.0 1.0
N B:ALA423 4.5 33.7 1.0
N B:SER426 4.6 28.4 1.0
OD1 B:ASP470 4.7 40.9 1.0
C B:ALA423 4.7 38.6 1.0
O B:ALA522 4.7 41.6 1.0
N B:LYS425 4.8 31.7 1.0
C B:LYS425 4.8 34.2 1.0
CB B:VAL424 4.8 37.1 1.0
CA B:LYS425 4.9 31.5 1.0
CB B:HIS520 4.9 33.7 1.0
CA B:CYS421 5.0 35.6 0.5
CA B:CYS421 5.0 34.2 0.5
CA B:HIS520 5.0 33.6 1.0

Reference:

J.Le Nours, E.M.M.Bulloch, Z.Zhang, D.R.Greenwood, M.J.Middleditch, J.M.J.Dickson, E.N.Baker. Structural Analyses of A Purine Biosynthetic Enzyme From Mycobacterium Tuberculosis Reveal A Novel Bound Nucleotide. J.Biol.Chem. V. 286 40706 2011.
ISSN: ISSN 0021-9258
PubMed: 21956117
DOI: 10.1074/JBC.M111.291138
Page generated: Mon Aug 12 10:00:07 2024

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