Chlorine in PDB 5joh: Crystal Structure of CSN5(2-257) in Complex with CNS5I-1B

The structure of Crystal Structure of CSN5(2-257) in Complex with CNS5I-1B, PDB code: 5joh was solved by M.Renatus, C.Wiesmann, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	57.01 / 1.99
Space group	I 4
Cell size a, b, c (Å), α, β, γ (°)	102.058, 102.058, 68.729, 90.00, 90.00, 90.00
R / Rfree (%)	22.6 / 24.8

The structure of Crystal Structure of CSN5(2-257) in Complex with CNS5I-1B also contains other interesting chemical elements:

Zinc

(Zn)

1 atom

The binding sites of Chlorine atom in the Crystal Structure of CSN5(2-257) in Complex with CNS5I-1B (pdb code 5joh). 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 CSN5(2-257) in Complex with CNS5I-1B, PDB code: 5joh:

Chlorine binding site 1 out of 1 in the Crystal Structure of CSN5(2-257) in Complex with CNS5I-1B


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 CSN5(2-257) in Complex with CNS5I-1B within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl302 b:55.5 occ:1.00 CL1 A:6M3302 0.0 55.5 1.0 C16 A:6M3302 1.7 54.4 1.0 C17 A:6M3302 2.7 54.6 1.0 C13 A:6M3302 2.7 57.8 1.0 C12 A:6M3302 3.0 58.8 1.0 CD2 A:HIS138 3.2 49.5 1.0 C3 A:6M3302 3.4 45.8 1.0 CB A:HIS138 3.5 41.6 1.0 N2 A:6M3302 3.5 43.4 1.0 CG A:HIS138 3.5 46.8 1.0 C7 A:6M3302 3.5 58.8 1.0 C6 A:6M3302 3.6 53.1 1.0 C11 A:6M3302 3.8 61.1 1.0 C18 A:6M3302 4.0 56.4 1.0 C20 A:6M3302 4.0 58.0 1.0 N4 A:6M3302 4.0 37.3 1.0 CB A:GLU76 4.1 48.4 1.0 C1 A:6M3302 4.1 42.6 1.0 O A:VAL77 4.2 45.1 1.0 CB A:MET78 4.2 46.4 1.0 NE2 A:HIS138 4.3 49.2 1.0 C19 A:6M3302 4.5 58.3 1.0 C5 A:6M3302 4.5 38.9 1.0 C8 A:6M3302 4.6 59.1 1.0 C A:VAL77 4.6 45.1 1.0 ND1 A:HIS138 4.6 49.0 1.0 CZ3 A:TRP136 4.6 46.8 1.0 CG A:GLU76 4.7 54.2 1.0 O A:SER139 4.8 42.6 1.0 CG A:MET78 4.8 51.9 1.0 N A:VAL77 4.8 45.5 1.0 CA A:HIS138 4.8 39.3 1.0 C10 A:6M3302 4.9 63.0 1.0 SD A:MET78 4.9 58.4 1.0 CE1 A:HIS138 5.0 48.7 1.0

A.Schlierf, E.Altmann, J.Quancard, A.B.Jefferson, R.Assenberg, M.Renatus, M.Jones, U.Hassiepen, M.Schaefer, M.Kiffe, A.Weiss, C.Wiesmann, R.Sedrani, J.Eder, B.Martoglio. Targeted Inhibition of the COP9 Signalosome For Treatment of Cancer. Nat Commun V. 7 13166 2016.
ISSN: ESSN 2041-1723
PubMed: 27774986
DOI: 10.1038/NCOMMS13166