Chlorine in PDB 5whh: Crystal Structure of Bcl-2-Related Protein A1 in Complex with Stapled Peptide (AQ7)T(0EH)Lrrfgd(MK8)Infrq(NH2)

The structure of Crystal Structure of Bcl-2-Related Protein A1 in Complex with Stapled Peptide (AQ7)T(0EH)Lrrfgd(MK8)Infrq(NH2), PDB code: 5whh was solved by H.-S.Seo, S.Dhe-Paganon, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	43.36 / 2.38
Space group	P 32 2 1
Cell size a, b, c (Å), α, β, γ (°)	86.710, 86.710, 40.360, 90.00, 90.00, 120.00
R / Rfree (%)	21.1 / 29.3

The binding sites of Chlorine atom in the Crystal Structure of Bcl-2-Related Protein A1 in Complex with Stapled Peptide (AQ7)T(0EH)Lrrfgd(MK8)Infrq(NH2) (pdb code 5whh). 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 Bcl-2-Related Protein A1 in Complex with Stapled Peptide (AQ7)T(0EH)Lrrfgd(MK8)Infrq(NH2), PDB code: 5whh:

Chlorine binding site 1 out of 1 in the Crystal Structure of Bcl-2-Related Protein A1 in Complex with Stapled Peptide (AQ7)T(0EH)Lrrfgd(MK8)Infrq(NH2)


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 Bcl-2-Related Protein A1 in Complex with Stapled Peptide (AQ7)T(0EH)Lrrfgd(MK8)Infrq(NH2) within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl201 b:32.0 occ:1.00 CB B:AQ775 3.6 34.8 1.0 CD A:LYS77 3.7 41.3 1.0 C8 B:AQ775 3.8 31.2 1.0 CA A:VAL74 3.8 29.6 1.0 N B:AQ775 3.9 42.4 1.0 CG2 A:VAL74 3.9 28.1 1.0 O A:GLN73 4.1 43.7 1.0 CB A:LYS77 4.2 35.8 1.0 CG A:LYS77 4.3 38.0 1.0 CB A:VAL74 4.3 27.6 1.0 CA B:AQ775 4.4 41.3 1.0 N A:VAL74 4.4 28.0 1.0 N1 B:AQ775 4.4 41.4 1.0 C A:GLN73 4.5 31.8 1.0 C7 B:AQ775 4.6 36.5 1.0 CG1 A:VAL74 4.7 28.4 1.0 CG A:GLN73 4.7 44.5 1.0 O A:VAL74 4.7 42.3 1.0 C4 B:AQ775 4.7 28.8 1.0 C3 B:AQ775 4.8 39.0 1.0 C A:VAL74 4.8 30.7 1.0 O A:HOH315 4.8 36.5 1.0 C5 B:AQ775 4.9 33.4 1.0 CE A:LYS77 4.9 59.5 1.0 NZ A:LYS77 5.0 65.5 1.0

E.P.Harvey, H.S.Seo, R.M.Guerra, G.H.Bird, S.Dhe-Paganon, L.D.Walensky. Crystal Structures of Anti-Apoptotic Bfl-1 and Its Complex with A Covalent Stapled Peptide Inhibitor. Structure V. 26 153 2018.
ISSN: ISSN 1878-4186
PubMed: 29276033
DOI: 10.1016/J.STR.2017.11.016