Chlorine in PDB 2nw4: Crystal Structure of the Rat Androgen Receptor Ligand Binding Domain Complex with Bms-564929

The structure of Crystal Structure of the Rat Androgen Receptor Ligand Binding Domain Complex with Bms-564929, PDB code: 2nw4 was solved by J.Ostrowski, J.E.Kuhns, J.A.Lupisella, M.C.Manfredi, B.C.Beehler, S.R.Krystek, Y.Bi, C.Sun, R.Seethala, R.Golla, P.G.Sleph, A.Fura, Y.An, K.F.Kish, J.S.Sack, K.A.Mookhtiar, G.J.Grover, L.G.Hamann, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	18.20 / 3.00
Space group	P 21 21 21
Cell size a, b, c (Å), α, β, γ (°)	55.640, 65.620, 70.830, 90.00, 90.00, 90.00
R / Rfree (%)	24.9 / 29.3

The binding sites of Chlorine atom in the Crystal Structure of the Rat Androgen Receptor Ligand Binding Domain Complex with Bms-564929 (pdb code 2nw4). 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 the Rat Androgen Receptor Ligand Binding Domain Complex with Bms-564929, PDB code: 2nw4:

Chlorine binding site 1 out of 1 in the Crystal Structure of the Rat Androgen Receptor Ligand Binding Domain Complex with Bms-564929


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 the Rat Androgen Receptor Ligand Binding Domain Complex with Bms-564929 within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl1 b:21.5 occ:1.00 CL1 A:8NH1 0.0 21.5 1.0 C2 A:8NH1 1.8 15.7 1.0 C3 A:8NH1 2.8 14.3 1.0 C9 A:8NH1 2.8 14.2 1.0 O A:MET745 3.1 8.9 1.0 C30 A:8NH1 3.1 12.7 1.0 C10 A:8NH1 3.2 11.6 1.0 CB A:MET749 3.2 14.1 1.0 CG A:MET749 3.3 17.2 1.0 C A:MET745 3.5 9.1 1.0 CE1 A:PHE764 3.7 17.9 1.0 CD1 A:PHE764 3.8 15.7 1.0 N11 A:8NH1 3.9 10.1 1.0 N A:VAL746 4.0 9.7 1.0 CB A:MET745 4.0 9.5 1.0 CA A:VAL746 4.0 11.3 1.0 C4 A:8NH1 4.1 14.8 1.0 C7 A:8NH1 4.1 15.0 1.0 CE A:MET787 4.2 26.7 1.0 CE A:MET749 4.2 19.9 1.0 CA A:MET745 4.4 8.7 1.0 SD A:MET749 4.6 18.8 1.0 C5 A:8NH1 4.7 14.5 1.0 CA A:MET749 4.7 14.2 1.0 CG2 A:VAL746 4.8 10.9 1.0 C A:VAL746 5.0 12.4 1.0 CZ A:PHE764 5.0 18.8 1.0

J.Ostrowski, J.E.Kuhns, J.A.Lupisella, M.C.Manfredi, B.C.Beehler, S.R.Krystek, Y.Bi, C.Sun, R.Seethala, R.Golla, P.G.Sleph, A.Fura, Y.An, K.F.Kish, J.S.Sack, K.A.Mookhtiar, G.J.Grover, L.G.Hamann. Pharmacological and X-Ray Structural Characterization of A Novel Selective Androgen Receptor Modulator: Potent Hyperanabolic Stimulation of Skeletal Muscle with Hypostimulation of Prostate in Rats. Endocrinology V. 148 4 2007.
ISSN: ISSN 0013-7227
PubMed: 17008401
DOI: 10.1210/EN.2006-0843