Chlorine in PDB 6mbe: Human Mcl-1 in Complex with the Designed Peptide DM7

The structure of Human Mcl-1 in Complex with the Designed Peptide DM7, PDB code: 6mbe was solved by J.M.Jenson, A.E.Keating, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	29.94 / 2.25
Space group	P 32 2 1
Cell size a, b, c (Å), α, β, γ (°)	80.758, 80.758, 57.950, 90.00, 90.00, 120.00
R / Rfree (%)	19.2 / 22.1

The binding sites of Chlorine atom in the Human Mcl-1 in Complex with the Designed Peptide DM7 (pdb code 6mbe). 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 Human Mcl-1 in Complex with the Designed Peptide DM7, PDB code: 6mbe:

Chlorine binding site 1 out of 1 in the Human Mcl-1 in Complex with the Designed Peptide DM7


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Human Mcl-1 in Complex with the Designed Peptide DM7 within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl401 b:33.6 occ:1.00 HB2 A:ASN260 3.0 40.4 1.0 O A:HOH526 3.1 32.5 1.0 HZ A:PHE318 3.1 40.3 1.0 HE1 A:PHE318 3.2 40.8 1.0 O B:HOH102 3.4 34.5 1.0 HB3 A:ASN260 3.7 40.4 1.0 CZ A:PHE318 3.7 33.5 1.0 CE1 A:PHE318 3.7 34.0 1.0 CB A:ASN260 3.8 33.6 1.0 HD22 A:ASN260 4.3 41.3 1.0 O B:HOH101 4.3 40.0 1.0 CG A:ASN260 4.5 34.2 1.0 H A:TRP261 4.6 38.9 1.0 ND2 A:ASN260 4.6 34.4 1.0 HA A:ASN260 4.8 39.1 1.0 CE2 A:PHE318 4.9 33.7 1.0 CA A:ASN260 4.9 32.5 1.0 CD1 A:PHE318 4.9 32.8 1.0

V.Frappier, J.M.Jenson, J.Zhou, G.Grigoryan, A.E.Keating. Tertiary Structural Motif Sequence Statistics Enable Facile Prediction and Design of Peptides That Bind Anti-Apoptotic Bfl-1 and Mcl-1. Structure V. 27 606 2019.
ISSN: ISSN 1878-4186
PubMed: 30773399
DOI: 10.1016/J.STR.2019.01.008