Chlorine in PDB 4ipz: Smbz Bound to Cyclophilin A

All present enzymatic activity of Smbz Bound to Cyclophilin A:
5.2.1.8;

The structure of Smbz Bound to Cyclophilin A, PDB code: 4ipz was solved by A.J.Price, D.A.Jacques, L.C.James, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	32.32 / 1.67
Space group	I 2 2 2
Cell size a, b, c (Å), α, β, γ (°)	54.180, 64.600, 80.070, 90.00, 90.00, 90.00
R / Rfree (%)	17.2 / 21.8

The binding sites of Chlorine atom in the Smbz Bound to Cyclophilin A (pdb code 4ipz). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 2 binding sites of Chlorine where determined in the Smbz Bound to Cyclophilin A, PDB code: 4ipz:
Jump to Chlorine binding site number: 1; 2;

Chlorine binding site 1 out of 2 in the Smbz Bound to Cyclophilin A


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Smbz Bound to Cyclophilin A within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl201 b:40.2 occ:1.00 ND2 A:ASN137 3.1 21.6 1.0 O A:HOH390 4.0 38.2 1.0 CG A:ASN137 4.0 20.3 1.0 CB A:ASN137 4.1 19.9 1.0 CD1 A:ILE138 4.4 15.8 1.0 O A:ASN137 4.6 18.4 1.0 C A:ASN137 4.8 17.4 1.0 CL A:CL202 4.8 53.8 1.0

Chlorine binding site 2 out of 2 in the Smbz Bound to Cyclophilin A


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of Smbz Bound to Cyclophilin A within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl202 b:53.8 occ:1.00 O A:HOH371 3.2 27.2 1.0 CD1 A:LEU17 3.7 16.7 1.0 O A:HOH475 3.9 44.7 1.0 CB A:ALA141 4.0 20.7 1.0 NH2 A:ARG144 4.0 33.5 1.0 O A:HOH408 4.4 34.5 1.0 O A:HOH373 4.5 25.0 1.0 O A:HOH360 4.5 26.5 1.0 CL A:CL201 4.8 40.2 1.0

J.Rasaiyaah, C.P.Tan, A.J.Fletcher, A.J.Price, C.Blondeau, L.Hilditch, D.A.Jacques, D.L.Selwood, L.C.James, M.Noursadeghi, G.J.Towers. Hiv-1 Evades Innate Immune Recognition Through Specific Cofactor Recruitment. Nature V. 503 402 2013.
ISSN: ISSN 0028-0836
PubMed: 24196705
DOI: 10.1038/NATURE12769