Chlorine in PDB 2hsa: Crystal Structure of 12-Oxophytodienoate Reductase 3 (OPR3) From Tomato

All present enzymatic activity of Crystal Structure of 12-Oxophytodienoate Reductase 3 (OPR3) From Tomato:
1.3.1.42;

The structure of Crystal Structure of 12-Oxophytodienoate Reductase 3 (OPR3) From Tomato, PDB code: 2hsa was solved by C.Breithaupt, T.Clausen, R.Huber, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	20.00 / 1.50
Space group	P 1 21 1
Cell size a, b, c (Å), α, β, γ (°)	57.904, 89.677, 81.378, 90.00, 109.46, 90.00
R / Rfree (%)	22.5 / 25.5

The binding sites of Chlorine atom in the Crystal Structure of 12-Oxophytodienoate Reductase 3 (OPR3) From Tomato (pdb code 2hsa). 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 12-Oxophytodienoate Reductase 3 (OPR3) From Tomato, PDB code: 2hsa:

Chlorine binding site 1 out of 1 in the Crystal Structure of 12-Oxophytodienoate Reductase 3 (OPR3) From Tomato


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 12-Oxophytodienoate Reductase 3 (OPR3) From Tomato within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl603 b:72.4 occ:1.00 OD1 A:ASP232 2.7 23.3 1.0 O A:HOH741 2.8 27.1 1.0 NZ A:LYS20 2.9 42.7 1.0 CE A:LYS20 2.9 39.3 1.0 O A:HOH764 3.1 30.1 1.0 CD A:LYS20 3.4 37.8 1.0 CE1 A:PHE21 3.5 36.9 1.0 CZ A:PHE21 3.6 33.5 1.0 O A:ASP232 3.7 20.0 1.0 CG A:ASP232 3.7 22.2 1.0 CG A:LYS20 3.8 34.3 1.0 CG A:ARG233 3.9 18.2 1.0 CB A:ASP232 4.0 19.3 1.0 C A:ASP232 4.1 18.5 1.0 O A:HOH733 4.2 25.0 1.0 CD1 A:PHE21 4.5 31.5 1.0 CE2 A:PHE21 4.5 36.5 1.0 O A:ASP180 4.6 21.2 1.0 CB A:LYS20 4.7 29.8 1.0 N A:ARG233 4.7 15.6 1.0 CD A:ARG233 4.7 20.5 1.0 CA A:ASP232 4.7 21.1 1.0 OD2 A:ASP232 4.8 24.0 1.0 CA A:ARG233 4.8 17.3 1.0 CB A:ARG233 5.0 21.3 1.0

C.Breithaupt, R.Kurzbauer, H.Lilie, A.Schaller, J.Strassner, R.Huber, P.Macheroux, T.Clausen. Crystal Structure of 12-Oxophytodienoate Reductase 3 From Tomato: Self-Inhibition By Dimerization. Proc.Natl.Acad.Sci.Usa V. 103 14337 2006.
ISSN: ISSN 0027-8424
PubMed: 16983071
DOI: 10.1073/PNAS.0606603103