Chlorine in PDB 7amc: SMBRD3(2), Bromodomain 2 of the Bromodomain 3 Protein From Schistosoma Mansoni in Complex with IBET726

The structure of SMBRD3(2), Bromodomain 2 of the Bromodomain 3 Protein From Schistosoma Mansoni in Complex with IBET726, PDB code: 7amc was solved by M.Schiedel, M.A.Mcdonough, S.J.Conway, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	43.98 / 1.22
Space group	C 2 2 21
Cell size a, b, c (Å), α, β, γ (°)	51.801, 83.25, 126.605, 90, 90, 90
R / Rfree (%)	15.9 / 17.6

The binding sites of Chlorine atom in the SMBRD3(2), Bromodomain 2 of the Bromodomain 3 Protein From Schistosoma Mansoni in Complex with IBET726 (pdb code 7amc). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 2 binding sites of Chlorine where determined in the SMBRD3(2), Bromodomain 2 of the Bromodomain 3 Protein From Schistosoma Mansoni in Complex with IBET726, PDB code: 7amc:
Jump to Chlorine binding site number: 1; 2;

Chlorine binding site 1 out of 2 in the SMBRD3(2), Bromodomain 2 of the Bromodomain 3 Protein From Schistosoma Mansoni in Complex with IBET726


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of SMBRD3(2), Bromodomain 2 of the Bromodomain 3 Protein From Schistosoma Mansoni in Complex with IBET726 within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl201 b:27.8 occ:1.00 CL1 A:73B201 0.0 27.8 1.0 C8 A:73B201 1.8 23.6 1.0 C7 A:73B201 2.7 22.2 1.0 C9 A:73B201 2.7 22.0 1.0 CB A:GLU105 3.8 18.2 1.0 C6 A:73B201 4.0 20.1 1.0 C10 A:73B201 4.0 19.6 1.0 CG A:GLU105 4.1 21.0 1.0 C2 A:EDO203 4.5 52.9 1.0 C5 A:73B201 4.5 18.6 1.0 O2 A:EDO203 4.6 52.8 1.0

Chlorine binding site 2 out of 2 in the SMBRD3(2), Bromodomain 2 of the Bromodomain 3 Protein From Schistosoma Mansoni in Complex with IBET726


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of SMBRD3(2), Bromodomain 2 of the Bromodomain 3 Protein From Schistosoma Mansoni in Complex with IBET726 within 5.0Å range: probe atom residue distance (Å) B Occ B:Cl201 b:25.4 occ:1.00 CL1 B:73B201 0.0 25.4 1.0 C8 B:73B201 1.8 20.6 1.0 C7 B:73B201 2.7 19.7 1.0 C9 B:73B201 2.7 18.7 1.0 CB B:GLU105 3.7 18.4 1.0 C6 B:73B201 4.0 18.6 1.0 C10 B:73B201 4.0 16.0 1.0 CG B:GLU105 4.1 47.9 1.0 C5 B:73B201 4.5 16.3 1.0

M.Schiedel, D.J.B.Mcardle, M.A.Mcdonough, S.J.Conway. SBM3, Bromodomain 3 From Schistosoma Mansoni in Complex with IBET726 To Be Published.