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Chlorine in PDB 2bu7: Crystal Structures of Human Pyruvate Dehydrogenase Kinase 2 Containing Physiological and Synthetic Ligands

Enzymatic activity of Crystal Structures of Human Pyruvate Dehydrogenase Kinase 2 Containing Physiological and Synthetic Ligands

All present enzymatic activity of Crystal Structures of Human Pyruvate Dehydrogenase Kinase 2 Containing Physiological and Synthetic Ligands:
2.7.1.99;

Protein crystallography data

The structure of Crystal Structures of Human Pyruvate Dehydrogenase Kinase 2 Containing Physiological and Synthetic Ligands, PDB code: 2bu7 was solved by T.R.Knoechel, A.D.Tucker, C.M.Robinson, C.Phillips, W.Taylor, P.J.Bungay, S.A.Kasten, T.E.Roche, D.G.Brown, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 30.00 / 2.40
Space group P 64
Cell size a, b, c (Å), α, β, γ (°) 108.876, 108.876, 84.025, 90.00, 90.00, 120.00
R / Rfree (%) n/a / n/a

Chlorine Binding Sites:

The binding sites of Chlorine atom in the Crystal Structures of Human Pyruvate Dehydrogenase Kinase 2 Containing Physiological and Synthetic Ligands (pdb code 2bu7). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total only one binding site of Chlorine was determined in the Crystal Structures of Human Pyruvate Dehydrogenase Kinase 2 Containing Physiological and Synthetic Ligands, PDB code: 2bu7:

Chlorine binding site 1 out of 1 in 2bu7

Go back to Chlorine Binding Sites List in 2bu7
Chlorine binding site 1 out of 1 in the Crystal Structures of Human Pyruvate Dehydrogenase Kinase 2 Containing Physiological and Synthetic Ligands


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Crystal Structures of Human Pyruvate Dehydrogenase Kinase 2 Containing Physiological and Synthetic Ligands within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl1386

b:51.8
occ:1.00
 CL1 A:TF31386 0.0 51.8 1.0
C2 A:TF31386 1.7 55.0 1.0
C4 A:TF31386 2.7 59.0 1.0
C1 A:TF31386 2.8 55.2 1.0
O1 A:TF31386 3.0 52.5 1.0
CD A:PRO64 3.4 41.2 1.0
CD1 A:TYR374 3.5 0.9 1.0
CD2 A:LEU63 3.7 42.7 1.0
CG A:PRO64 3.8 41.0 1.0
CB A:ASN142 4.0 41.8 1.0
CE1 A:TYR374 4.0 0.3 1.0
C7 A:TF31386 4.1 62.1 1.0
C3 A:TF31386 4.1 57.5 1.0
CG A:TYR374 4.3 0.4 1.0
CG A:ASN142 4.3 44.0 1.0
C6 A:TF31386 4.4 47.5 1.0
ND2 A:ASN142 4.4 43.4 1.0
CB A:TYR374 4.5 0.1 1.0
C5 A:TF31386 4.6 60.3 1.0
C11 A:TF31386 4.6 43.0 1.0
N A:PRO64 4.7 41.7 1.0
CA A:LEU63 4.8 46.0 1.0
CG A:LEU63 4.9 45.0 1.0
OD1 A:ASN142 5.0 44.7 1.0

Reference:

T.R.Knoechel, A.D.Tucker, C.M.Robinson, C.Phillips, W.Taylor, P.J.Bungay, S.A.Kasten, T.E.Roche, D.G.Brown. Regulatory Roles of the N-Terminal Domain Based on Crystal Structures of Human Pyruvate Dehydrogenase Kinase 2 Containing Physiological and Synthetic Ligands. Biochemistry V. 45 402 2006.
ISSN: ISSN 0006-2960
PubMed: 16401071
DOI: 10.1021/BI051402S
Page generated: Sat Jul 20 05:54:50 2024

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