Bromine in PDB 8z3j: Benzbromarone Interferes with the Interaction Between HSP90 and AHA1 By Interacting with Both of Them

The structure of Benzbromarone Interferes with the Interaction Between HSP90 and AHA1 By Interacting with Both of Them, PDB code: 8z3j was solved by L.Shi, Y.Zhong, J.Tang, Z.Xu, N.Zhang, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	42.13 / 1.52
Space group	I 2 2 2
Cell size a, b, c (Å), α, β, γ (°)	54.216, 66.802, 68.2, 90, 90, 90
R / Rfree (%)	17 / 19.9

The binding sites of Bromine atom in the Benzbromarone Interferes with the Interaction Between HSP90 and AHA1 By Interacting with Both of Them (pdb code 8z3j). This binding sites where shown within 5.0 Angstroms radius around Bromine atom.
In total 2 binding sites of Bromine where determined in the Benzbromarone Interferes with the Interaction Between HSP90 and AHA1 By Interacting with Both of Them, PDB code: 8z3j:
Jump to Bromine binding site number: 1; 2;

Bromine binding site 1 out of 2 in the Benzbromarone Interferes with the Interaction Between HSP90 and AHA1 By Interacting with Both of Them


Mono view


Stereo pair view

A full contact list of Bromine with other atoms in the Br binding site number 1 of Benzbromarone Interferes with the Interaction Between HSP90 and AHA1 By Interacting with Both of Them within 5.0Å range: probe atom residue distance (Å) B Occ A:Br401 b:20.2 occ:1.00 BR1 A:R75401 0.0 20.2 1.0 CAD A:R75401 1.9 15.7 1.0 CAE A:R75401 2.8 16.8 1.0 CAC A:R75401 2.8 14.1 1.0 OAG A:R75401 3.0 17.2 1.0 NH2 A:ARG314 3.6 13.9 1.0 CG A:ASN256 3.6 17.5 1.0 ND2 A:ASN256 3.8 17.3 1.0 CB A:ASN256 3.8 12.7 1.0 OD1 A:ASN256 3.9 20.9 1.0 CAF A:R75401 4.1 16.6 1.0 CAB A:R75401 4.1 13.8 1.0 O A:HOH556 4.4 14.9 1.0 CAA A:R75401 4.6 14.3 1.0 CZ A:ARG314 4.7 12.1 1.0

Bromine binding site 2 out of 2 in the Benzbromarone Interferes with the Interaction Between HSP90 and AHA1 By Interacting with Both of Them


Mono view


Stereo pair view

A full contact list of Bromine with other atoms in the Br binding site number 2 of Benzbromarone Interferes with the Interaction Between HSP90 and AHA1 By Interacting with Both of Them within 5.0Å range: probe atom residue distance (Å) B Occ A:Br401 b:16.9 occ:1.00 BR2 A:R75401 0.0 16.9 1.0 CAB A:R75401 1.9 13.8 1.0 CAA A:R75401 2.8 14.3 1.0 CAC A:R75401 2.9 14.1 1.0 OAG A:R75401 3.1 17.2 1.0 O A:ARG314 3.7 10.6 1.0 CZ A:PHE276 3.8 10.4 1.0 CA A:GLY318 3.8 13.4 1.0 CG A:ARG314 4.0 11.9 1.0 CE2 A:TYR322 4.0 24.6 1.0 CD2 A:TYR322 4.0 20.7 1.0 N A:GLY318 4.0 13.0 1.0 CE1 A:PHE276 4.1 11.4 1.0 CAD A:R75401 4.1 15.7 1.0 CAF A:R75401 4.1 16.6 1.0 NE A:ARG314 4.4 13.5 1.0 CAR A:R75401 4.4 20.0 1.0 CAE A:R75401 4.6 16.8 1.0 C A:ARG314 4.7 10.3 1.0 CD A:ARG314 4.8 12.1 1.0 CG A:GLN317 4.8 29.4 1.0 C A:GLN317 4.9 13.2 1.0 CE2 A:PHE276 4.9 10.6 1.0 CAQ A:R75401 4.9 19.4 1.0 CG A:TYR322 4.9 19.8 1.0 CZ A:TYR322 4.9 30.2 1.0

Y.Zhong, L.Shi. Benzbromarone Interferes with the Interaction Between HSP90 and AHA1 By Interacting with Both of Them To Be Published.