Chlorine in PDB 4c4y: Crystal Structure of Human Bifunctional Epoxide Hydroxylase 2 Complexed with A4

All present enzymatic activity of Crystal Structure of Human Bifunctional Epoxide Hydroxylase 2 Complexed with A4:
3.1.3.76; 3.3.2.10;

The structure of Crystal Structure of Human Bifunctional Epoxide Hydroxylase 2 Complexed with A4, PDB code: 4c4y was solved by J.Pilger, A.Mazur, P.Monecke, H.Schreuder, B.Elshorst, T.Langer, A.Schiffer, I.Krimm, M.Wegstroth, D.Lee, G.Hessler, K.-U.Wendt, S.Becker, C.Griesinger, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	40.82 / 2.41
Space group	P 21 2 21
Cell size a, b, c (Å), α, β, γ (°)	81.640, 46.340, 80.290, 90.00, 90.00, 90.00
R / Rfree (%)	25.81 / 31.48

The binding sites of Chlorine atom in the Crystal Structure of Human Bifunctional Epoxide Hydroxylase 2 Complexed with A4 (pdb code 4c4y). 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 Bifunctional Epoxide Hydroxylase 2 Complexed with A4, PDB code: 4c4y:

Chlorine binding site 1 out of 1 in the Crystal Structure of Human Bifunctional Epoxide Hydroxylase 2 Complexed with A4


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 Bifunctional Epoxide Hydroxylase 2 Complexed with A4 within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl1548 b:51.9 occ:0.93 CL9 A:7WI1548 0.0 51.9 0.9 C5 A:7WI1548 1.7 51.2 0.9 C8 A:7WI1548 2.7 51.1 0.9 C2 A:7WI1548 2.7 50.8 0.9 CZ A:PHE387 3.6 39.7 1.0 CE2 A:PHE387 3.6 41.7 1.0 CD2 A:LEU428 3.9 68.4 1.0 C7 A:7WI1548 4.0 50.8 0.9 C1 A:7WI1548 4.0 50.2 0.9 CD1 A:LEU428 4.0 66.0 1.0 CD2 A:LEU408 4.1 41.9 1.0 CE1 A:PHE267 4.1 22.8 1.0 CD2 A:TYR383 4.4 48.3 1.0 CE A:MET419 4.5 67.8 1.0 CD1 A:PHE267 4.5 21.9 1.0 C4 A:7WI1548 4.5 50.3 0.9 SD A:MET419 4.5 71.2 1.0 CE2 A:TYR383 4.6 49.0 1.0 CG A:LEU428 4.6 65.9 1.0 OH A:TYR466 4.8 35.3 1.0 CE1 A:PHE387 4.9 40.6 1.0 CD2 A:PHE387 5.0 38.9 1.0

J.Pilger, A.Mazur, P.Monecke, H.Schreuder, B.Elshorst, T.Langer, A.Schiffer, I.Krimm, M.Wegstroth, D.Lee, G.Hessler, K.-U.Wendt, S.Becker, C.Griesinger. A Combination of Spin Diffusion Methods For the Determination of Protein-Ligand Complex Structural Ensembles To Be Published.