Chlorine in PDB 6oqc: Crystal Structure of MCL1 with Inhibitor 9

The structure of Crystal Structure of MCL1 with Inhibitor 9, PDB code: 6oqc was solved by X.Huang, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	50.00 / 1.80
Space group	P 21 21 21
Cell size a, b, c (Å), α, β, γ (°)	43.354, 84.785, 89.806, 90.00, 90.00, 90.00
R / Rfree (%)	19.6 / 23.3

The binding sites of Chlorine atom in the Crystal Structure of MCL1 with Inhibitor 9 (pdb code 6oqc). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 2 binding sites of Chlorine where determined in the Crystal Structure of MCL1 with Inhibitor 9, PDB code: 6oqc:
Jump to Chlorine binding site number: 1; 2;

Chlorine binding site 1 out of 2 in the Crystal Structure of MCL1 with Inhibitor 9


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 MCL1 with Inhibitor 9 within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl501 b:29.0 occ:1.00 CL1 A:N0S501 0.0 29.0 1.0 C15 A:N0S501 1.7 25.4 1.0 C14 A:N0S501 2.7 25.1 1.0 C16 A:N0S501 2.7 25.6 1.0 CD1 A:LEU290 3.4 31.9 1.0 CA A:GLY271 3.8 25.6 1.0 CD1 A:ILE294 3.8 26.9 1.0 SD A:MET250 4.0 30.1 1.0 C13 A:N0S501 4.0 29.3 1.0 CG1 A:ILE294 4.0 27.5 1.0 C10 A:N0S501 4.0 22.5 1.0 CG A:LEU290 4.2 35.8 1.0 CD1 A:LEU246 4.3 28.8 1.0 N A:GLY271 4.3 25.0 1.0 CG2 A:VAL274 4.3 26.3 1.0 CB A:VAL274 4.5 26.1 1.0 C19 A:N0S501 4.5 24.1 1.0 CE A:MET250 4.6 27.6 1.0 CD2 A:LEU290 4.6 34.5 1.0 CG A:MET250 4.7 22.8 1.0 CD2 A:PHE270 4.7 24.2 1.0 O A:PHE270 4.7 27.1 1.0 C A:PHE270 4.8 26.4 1.0 CG1 A:VAL274 4.8 27.2 1.0 CB A:LEU246 4.9 28.7 1.0 C A:GLY271 4.9 27.7 1.0 O A:GLY271 5.0 24.5 1.0

Chlorine binding site 2 out of 2 in the Crystal Structure of MCL1 with Inhibitor 9


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of Crystal Structure of MCL1 with Inhibitor 9 within 5.0Å range: probe atom residue distance (Å) B Occ B:Cl501 b:31.7 occ:1.00 CL1 B:N0S501 0.0 31.7 1.0 C15 B:N0S501 1.7 29.3 1.0 C14 B:N0S501 2.7 25.6 1.0 C16 B:N0S501 2.7 25.6 1.0 CD1 B:LEU290 3.5 35.7 1.0 CA B:GLY271 3.8 24.7 1.0 CD1 B:ILE294 3.9 28.2 1.0 SD B:MET250 4.0 30.7 1.0 C13 B:N0S501 4.0 25.7 1.0 CG1 B:ILE294 4.0 31.0 1.0 C10 B:N0S501 4.0 23.9 1.0 N B:GLY271 4.3 26.1 1.0 CG2 B:VAL274 4.3 30.6 1.0 CG B:LEU290 4.4 41.0 1.0 CD1 B:LEU246 4.4 29.2 1.0 CB B:VAL274 4.4 31.6 1.0 C19 B:N0S501 4.5 26.6 1.0 CE B:MET250 4.5 29.7 1.0 CD2 B:LEU290 4.6 39.9 1.0 CG B:MET250 4.6 28.2 1.0 CG1 B:VAL274 4.7 31.4 1.0 CD2 B:PHE270 4.8 26.9 1.0 O B:PHE270 4.8 26.4 1.0 C B:PHE270 4.8 28.4 1.0 C B:GLY271 4.9 25.1 1.0

X.Huang, X.Huang. N/A N/A.
ISSN: ISSN 2159-8274
PubMed: 30254093
DOI: 10.1158/2159-8290.CD-18-0387