Chlorine in PDB 4u0e: Hexameric Hiv-1 Ca in Complex with PF3450074

The structure of Hexameric Hiv-1 Ca in Complex with PF3450074, PDB code: 4u0e 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)	78.99 / 2.04
Space group	P 6
Cell size a, b, c (Å), α, β, γ (°)	91.210, 91.210, 56.340, 90.00, 90.00, 120.00
R / Rfree (%)	19.8 / 23.9

The binding sites of Chlorine atom in the Hexameric Hiv-1 Ca in Complex with PF3450074 (pdb code 4u0e). 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 Hexameric Hiv-1 Ca in Complex with PF3450074, PDB code: 4u0e:

Chlorine binding site 1 out of 1 in the Hexameric Hiv-1 Ca in Complex with PF3450074


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Hexameric Hiv-1 Ca in Complex with PF3450074 within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl301 b:23.9 occ:1.00 N A:GLY61 3.2 17.9 1.0 CG A:GLN63 3.7 16.8 1.0 NE2 A:GLN63 3.8 17.0 1.0 CD A:GLN63 3.9 17.1 1.0 CA A:GLY61 4.0 17.7 1.0 CA A:GLY60 4.1 20.8 1.0 C A:GLY60 4.1 18.8 1.0 OE1 A:GLN63 4.7 19.2 1.0 O A:GLY61 4.7 17.5 1.0 O A:VAL59 4.7 17.4 1.0 C A:GLY61 4.8 16.3 1.0

A.J.Price, D.A.Jacques, W.A.Mcewan, A.J.Fletcher, S.Essig, J.W.Chin, U.D.Halambage, C.Aiken, L.C.James. Host Cofactors and Pharmacologic Ligands Share An Essential Interface in Hiv-1 Capsid That Is Lost Upon Disassembly. Plos Pathog. V. 10 04459 2014.
ISSN: ESSN 1553-7374
PubMed: 25356722
DOI: 10.1371/JOURNAL.PPAT.1004459