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Chlorine in PDB 3e7v: Crystal Structure of Human Haspin with A Pyrazolo-Pyrimidine Ligand

Enzymatic activity of Crystal Structure of Human Haspin with A Pyrazolo-Pyrimidine Ligand

All present enzymatic activity of Crystal Structure of Human Haspin with A Pyrazolo-Pyrimidine Ligand:
2.7.11.1;

Protein crystallography data

The structure of Crystal Structure of Human Haspin with A Pyrazolo-Pyrimidine Ligand, PDB code: 3e7v was solved by P.Filippakopoulos, J.Eswaran, T.Keates, N.Burgess-Brown, O.Fedorov, A.C.W.Pike, F.Von Delft, C.H.Arrowsmith, A.M.Edwards, M.Wickstroem, C.Bountra, S.Knapp, Structural Genomics Consortium (Sgc), with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 25.44 / 2.00
Space group P 21 21 21
Cell size a, b, c (Å), α, β, γ (°) 78.497, 86.952, 68.460, 90.00, 90.00, 90.00
R / Rfree (%) 16.8 / 22.5

Other elements in 3e7v:

The structure of Crystal Structure of Human Haspin with A Pyrazolo-Pyrimidine Ligand also contains other interesting chemical elements:

Nickel (Ni) 1 atom

Chlorine Binding Sites:

The binding sites of Chlorine atom in the Crystal Structure of Human Haspin with A Pyrazolo-Pyrimidine Ligand (pdb code 3e7v). 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 Structure of Human Haspin with A Pyrazolo-Pyrimidine Ligand, PDB code: 3e7v:

Chlorine binding site 1 out of 1 in 3e7v

Go back to Chlorine Binding Sites List in 3e7v
Chlorine binding site 1 out of 1 in the Crystal Structure of Human Haspin with A Pyrazolo-Pyrimidine Ligand


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Crystal Structure of Human Haspin with A Pyrazolo-Pyrimidine Ligand within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl1

b:29.6
occ:1.00
 CL1 A:DZO1 0.0 29.6 1.0
C12 A:DZO1 1.7 29.7 1.0
C17 A:DZO1 2.7 32.4 1.0
C10 A:DZO1 2.7 26.8 1.0
OD2 A:ASP687 3.2 27.2 1.0
O A:HOH1070 3.6 41.8 1.0
CZ A:PHE495 3.6 26.6 1.0
CG A:ASP687 3.7 21.2 1.0
CG2 A:VAL498 3.8 19.1 1.0
C14 A:DZO1 3.9 20.2 1.0
C15 A:DZO1 4.0 38.7 1.0
C9 A:DZO1 4.0 24.4 1.0
CE1 A:PHE495 4.0 25.4 1.0
OD1 A:ASN654 4.2 21.6 1.0
CD1 A:ILE686 4.2 16.1 1.0
OD1 A:ASP687 4.2 23.0 1.0
C13 A:DZO1 4.3 16.2 1.0
CB A:ASP687 4.4 20.0 1.0
O A:HOH1069 4.5 41.3 1.0
C16 A:DZO1 4.5 26.1 1.0
C18 A:DZO1 4.7 18.9 1.0
CE2 A:PHE495 4.7 35.7 1.0
O A:GLU492 4.8 25.6 1.0
CB A:VAL498 4.9 20.9 1.0
N1 A:DZO1 5.0 20.4 1.0

Reference:

P.Filippakopoulos, J.Eswaran, T.Keates, N.Burgess-Brown, O.Fedorov, A.C.W.Pike, F.Von Delft, C.H.Arrowsmith, A.M.Edwards, M.Wickstroem, C.Bountra, S.Knapp. Crystal Structure of Human Haspin with A Pyrazolo-Pyrimidine Ligand To Be Published.
Page generated: Sat Dec 12 09:39:46 2020

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