Chlorine in PDB 7rl2: Crystal Structure of the Human Cytochrome P450 2C9*8 (CYP2C9*8) Genetic Variant in Complex with the Drug Losartan

Enzymatic activity of Crystal Structure of the Human Cytochrome P450 2C9*8 (CYP2C9*8) Genetic Variant in Complex with the Drug Losartan

All present enzymatic activity of Crystal Structure of the Human Cytochrome P450 2C9*8 (CYP2C9*8) Genetic Variant in Complex with the Drug Losartan:
1.14.14.1; 1.14.14.51; 1.14.14.52; 1.14.14.53;

Protein crystallography data

The structure of Crystal Structure of the Human Cytochrome P450 2C9*8 (CYP2C9*8) Genetic Variant in Complex with the Drug Losartan, PDB code: 7rl2 was solved by M.B.Shah, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 37.61 / 2.23
Space group I 2 2 2
Cell size a, b, c (Å), α, β, γ (°) 75, 143.211, 163.821, 90, 90, 90
R / Rfree (%) 17.8 / 22.4

Other elements in 7rl2:

The structure of Crystal Structure of the Human Cytochrome P450 2C9*8 (CYP2C9*8) Genetic Variant in Complex with the Drug Losartan also contains other interesting chemical elements:

Iron (Fe) 1 atom
Potassium (K) 1 atom

Chlorine Binding Sites:

The binding sites of Chlorine atom in the Crystal Structure of the Human Cytochrome P450 2C9*8 (CYP2C9*8) Genetic Variant in Complex with the Drug Losartan (pdb code 7rl2). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 2 binding sites of Chlorine where determined in the Crystal Structure of the Human Cytochrome P450 2C9*8 (CYP2C9*8) Genetic Variant in Complex with the Drug Losartan, PDB code: 7rl2:
Jump to Chlorine binding site number: 1; 2;

Chlorine binding site 1 out of 2 in 7rl2

Go back to Chlorine Binding Sites List in 7rl2
Chlorine binding site 1 out of 2 in the Crystal Structure of the Human Cytochrome P450 2C9*8 (CYP2C9*8) Genetic Variant in Complex with the Drug Losartan


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 the Human Cytochrome P450 2C9*8 (CYP2C9*8) Genetic Variant in Complex with the Drug Losartan within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl502

b:56.3
occ:1.00
 CL A:LSN502 0.0 56.3 1.0
C17 A:LSN502 1.8 51.5 1.0
N6 A:LSN502 2.9 46.7 1.0
C15 A:LSN502 2.9 47.5 1.0
C16 A:LSN502 3.4 45.6 1.0
CG2 A:VAL237 3.7 58.9 1.0
ND2 A:ASN204 3.8 44.1 1.0
CB A:LEU233 3.8 47.3 1.0
CB A:ALA106 4.0 54.1 1.0
N5 A:LSN502 4.0 48.0 1.0
C18 A:LSN502 4.0 52.9 1.0
O A:ALA106 4.1 52.1 1.0
O A:LSN502 4.1 54.8 1.0
CD2 A:LEU233 4.2 49.9 1.0
CG A:LEU233 4.4 49.6 1.0
O A:LEU233 4.4 44.0 1.0
CD1 A:LEU208 4.4 47.6 1.0
CD1 A:LEU233 4.5 48.6 1.0
C A:LEU233 4.5 48.9 1.0
O A:HOH624 4.5 53.9 1.0
CA A:LEU233 4.6 49.9 1.0
CG A:ASN204 4.7 53.7 1.0
CA A:ALA106 4.8 53.0 1.0
CD2 A:LEU208 4.8 46.9 1.0
C A:ALA106 4.9 49.3 1.0
CG A:LEU208 4.9 43.1 1.0
NE A:ARG108 5.0 48.5 1.0

Chlorine binding site 2 out of 2 in 7rl2

Go back to Chlorine Binding Sites List in 7rl2
Chlorine binding site 2 out of 2 in the Crystal Structure of the Human Cytochrome P450 2C9*8 (CYP2C9*8) Genetic Variant in Complex with the Drug Losartan


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of Crystal Structure of the Human Cytochrome P450 2C9*8 (CYP2C9*8) Genetic Variant in Complex with the Drug Losartan within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl503

b:111.0
occ:1.00
 CL A:LSN503 0.0 111.0 1.0
C17 A:LSN503 1.7 66.7 1.0
N6 A:LSN503 2.7 67.4 1.0
C15 A:LSN503 3.0 59.4 1.0
CD A:LYS232 3.2 60.1 1.0
NZ A:LYS232 3.5 66.4 1.0
CE A:LYS232 3.6 63.4 1.0
C16 A:LSN503 3.6 64.1 1.0
C18 A:LSN503 3.9 72.6 1.0
N5 A:LSN503 4.1 58.4 1.0
CG A:LYS232 4.3 56.7 1.0
CB A:LYS232 4.6 51.0 1.0
CA A:LYS232 4.7 48.5 1.0
O A:LSN503 5.0 66.2 1.0

Reference:

S.J.Parikh, S.Kamat, M.Phillips, S.P.Boyson, T.Yarbrough, D.Davie, Q.Zhang, K.C.Glass, M.B.Shah. Insights Into the Genetic Variations of Human Cytochrome P450 2C9: Structural Analysis, Characterization and Comparison Int J Mol Sci V. 22 2021.
ISSN: ESSN 1422-0067
DOI: 10.3390/IJMS221910206
Page generated: Tue Jul 30 03:42:28 2024

Last articles

Zn in 9JPJ
Zn in 9JP7
Zn in 9JPK
Zn in 9JPL
Zn in 9GN6
Zn in 9GN7
Zn in 9GKU
Zn in 9GKW
Zn in 9GKX
Zn in 9GL0
© Copyright 2008-2020 by atomistry.com
Home   |    Site Map   |    Copyright   |    Contact us   |    Privacy