Chlorine in PDB 1vru: High Resolution Structures of Hiv-1 Rt From Four Rt- Inhibitor Complexes

All present enzymatic activity of High Resolution Structures of Hiv-1 Rt From Four Rt- Inhibitor Complexes:
2.7.7.49;

The structure of High Resolution Structures of Hiv-1 Rt From Four Rt- Inhibitor Complexes, PDB code: 1vru was solved by J.Ren, R.Esnouf, E.Garman, D.Somers, C.Ross, I.Kirby, J.Keeling, G.Darby, Y.Jones, D.Stuart, D.Stammers, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	25.00 / 2.40
Space group	P 21 21 21
Cell size a, b, c (Å), α, β, γ (°)	143.200, 116.800, 66.400, 90.00, 90.00, 90.00
R / Rfree (%)	18.7 / n/a

The binding sites of Chlorine atom in the High Resolution Structures of Hiv-1 Rt From Four Rt- Inhibitor Complexes (pdb code 1vru). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 2 binding sites of Chlorine where determined in the High Resolution Structures of Hiv-1 Rt From Four Rt- Inhibitor Complexes, PDB code: 1vru:
Jump to Chlorine binding site number: 1; 2;

Chlorine binding site 1 out of 2 in the High Resolution Structures of Hiv-1 Rt From Four Rt- Inhibitor Complexes


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of High Resolution Structures of Hiv-1 Rt From Four Rt- Inhibitor Complexes within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl999 b:32.0 occ:1.00 CL2 A:AAP999 0.0 32.0 1.0 C2 A:AAP999 1.7 20.4 1.0 C3 A:AAP999 2.7 21.2 1.0 C1 A:AAP999 2.8 23.5 1.0 CA A:AAP999 3.1 29.8 1.0 N' A:AAP999 3.2 28.0 1.0 C A:AAP999 3.2 34.6 1.0 O A:AAP999 3.4 34.6 1.0 O' A:AAP999 3.5 29.4 1.0 O A:HOH1017 3.7 43.5 1.0 N A:AAP999 3.9 32.9 1.0 C4 A:AAP999 4.0 16.5 1.0 CG1 A:VAL179 4.0 20.4 1.0 C6 A:AAP999 4.1 19.8 1.0 O A:LYS101 4.1 34.6 1.0 CG A:LYS103 4.1 24.7 1.0 CE A:LYS103 4.2 28.4 1.0 C1' A:AAP999 4.3 25.3 1.0 CB A:LEU100 4.4 15.8 1.0 CB A:VAL179 4.5 30.5 1.0 C' A:AAP999 4.5 36.0 1.0 CD1 A:LEU100 4.5 13.5 1.0 C5 A:AAP999 4.6 14.8 1.0 CD2 A:LEU100 4.6 21.9 1.0 CG A:LEU100 4.7 17.0 1.0 CD A:LYS103 4.8 23.3 1.0 CG2 A:VAL179 4.8 34.0 1.0 C2' A:AAP999 4.9 26.5 1.0

Chlorine binding site 2 out of 2 in the High Resolution Structures of Hiv-1 Rt From Four Rt- Inhibitor Complexes


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of High Resolution Structures of Hiv-1 Rt From Four Rt- Inhibitor Complexes within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl999 b:30.6 occ:1.00 CL6 A:AAP999 0.0 30.6 1.0 C6 A:AAP999 1.7 19.8 1.0 C5 A:AAP999 2.6 14.8 1.0 C1 A:AAP999 2.7 23.5 1.0 CA A:AAP999 3.1 29.8 1.0 C6' A:AAP999 3.4 17.9 1.0 CG1 A:VAL106 3.8 33.4 1.0 CD2 A:TYR188 3.9 33.5 1.0 C4 A:AAP999 3.9 16.5 1.0 N' A:AAP999 4.0 28.0 1.0 C2 A:AAP999 4.0 20.4 1.0 CD2 A:PHE227 4.1 35.9 1.0 C1' A:AAP999 4.1 25.3 1.0 C A:AAP999 4.2 34.6 1.0 C5' A:AAP999 4.3 23.3 1.0 CM5 A:AAP999 4.3 22.1 1.0 O A:AAP999 4.4 34.6 1.0 CE2 A:PHE227 4.4 35.1 1.0 CD1 A:LEU234 4.4 36.7 1.0 C3 A:AAP999 4.5 21.2 1.0 CB A:LEU234 4.5 35.0 1.0 CE2 A:TYR188 4.6 41.2 1.0 CG A:TYR188 4.6 36.1 1.0 CB A:TYR188 4.6 33.5 1.0 CG2 A:VAL106 4.7 32.6 1.0 CB A:VAL106 4.7 35.2 1.0

J.Ren, R.Esnouf, E.Garman, D.Somers, C.Ross, I.Kirby, J.Keeling, G.Darby, Y.Jones, D.Stuart. High Resolution Structures of Hiv-1 Rt From Four Rt-Inhibitor Complexes. Nat.Struct.Biol. V. 2 293 1995.
ISSN: ISSN 1072-8368
PubMed: 7540934
DOI: 10.1038/NSB0495-293