Chlorine in PDB 8bzb: Co-Soak Stabilizers For Era - 14-3-3 Interaction (884_AZ275)

The structure of Co-Soak Stabilizers For Era - 14-3-3 Interaction (884_AZ275), PDB code: 8bzb was solved by E.J.Visser, E.Sijbesma, C.Ottmann, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	40.95 / 1.70
Space group	C 2 2 21
Cell size a, b, c (Å), α, β, γ (°)	81.905, 112.491, 62.402, 90, 90, 90
R / Rfree (%)	16.3 / 19.3

The structure of Co-Soak Stabilizers For Era - 14-3-3 Interaction (884_AZ275) also contains other interesting chemical elements:

Magnesium

(Mg)

3 atoms

The binding sites of Chlorine atom in the Co-Soak Stabilizers For Era - 14-3-3 Interaction (884_AZ275) (pdb code 8bzb). 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 Co-Soak Stabilizers For Era - 14-3-3 Interaction (884_AZ275), PDB code: 8bzb:

Chlorine binding site 1 out of 1 in the Co-Soak Stabilizers For Era - 14-3-3 Interaction (884_AZ275)


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Co-Soak Stabilizers For Era - 14-3-3 Interaction (884_AZ275) within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl304 b:16.2 occ:1.00 CL1 A:GEH304 0.0 16.2 1.0 C02 A:GEH304 1.7 15.8 1.0 C17 A:GEH304 2.7 13.1 1.0 C03 A:GEH304 2.7 17.2 1.0 HE3 A:LYS122 2.8 8.7 1.0 H14 A:GEH304 2.8 15.7 1.0 H1 A:GEH304 2.8 20.6 1.0 HA A:ILE168 3.0 9.1 1.0 HD3 A:LYS122 3.1 8.2 1.0 HG23 A:ILE168 3.4 9.9 1.0 CE A:LYS122 3.5 7.2 1.0 HG23 B:VAL595 3.5 12.4 1.0 HG12 A:ILE168 3.5 14.9 1.0 HE2 A:PHE119 3.6 20.7 1.0 HA3 A:GLY171 3.6 9.9 1.0 HZ1 A:LYS122 3.6 11.3 1.0 CD A:LYS122 3.6 6.8 1.0 HD2 A:LYS122 3.7 8.2 1.0 HD2 A:PHE119 3.9 16.3 1.0 CA A:ILE168 4.0 7.6 1.0 O A:HOH599 4.0 24.4 1.0 C16 A:GEH304 4.0 16.2 1.0 C04 A:GEH304 4.0 14.1 1.0 CE2 A:PHE119 4.0 17.2 1.0 NZ A:LYS122 4.0 9.4 1.0 CD2 A:PHE119 4.2 13.5 1.0 CG2 A:ILE168 4.3 8.2 1.0 O A:ILE168 4.3 6.3 1.0 HZ3 A:LYS122 4.3 11.3 1.0 CG1 A:ILE168 4.3 12.4 1.0 HE2 A:LYS122 4.3 8.7 1.0 CG2 B:VAL595 4.4 10.3 1.0 CB A:ILE168 4.4 8.1 1.0 HG21 B:VAL595 4.4 12.4 1.0 CA A:GLY171 4.5 8.2 1.0 C05 A:GEH304 4.5 17.7 1.0 O A:PRO167 4.5 6.6 1.0 H A:LEU172 4.6 6.5 1.0 C A:ILE168 4.6 6.0 1.0 H A:GLY171 4.7 7.6 1.0 HG13 A:ILE168 4.7 14.9 1.0 C A:GLY171 4.8 6.1 1.0 N A:LEU172 4.8 5.4 1.0 HZ2 A:LYS122 4.8 11.3 1.0 HG22 A:ILE168 4.8 9.9 1.0 H13 A:GEH304 4.8 19.5 1.0 HG22 B:VAL595 4.8 12.4 1.0 H7 A:GEH304 4.8 17.0 1.0 HG21 A:ILE168 4.8 9.9 1.0 N A:ILE168 4.9 7.0 1.0 O B:HOH603 4.9 22.2 1.0 OXT B:VAL595 4.9 15.7 1.0 H16 A:GEH304 4.9 20.8 1.0 HA A:PHE119 5.0 6.8 1.0

E.J.Visser, P.Jaishankar, E.Sijbesma, M.A.M.Pennings, E.M.F.Vandenboorn, X.Guillory, R.J.Neitz, J.Morrow, S.Dutta, A.R.Renslo, L.Brunsveld, M.R.Arkin, C.Ottmann. From Tethered to Freestanding Stabilizers of 14-3-3 Protein-Protein Interactions Via Fragment Linking. Angew.Chem.Int.Ed.Engl. 08004 2023.
ISSN: ESSN 1521-3773
PubMed: 37455289
DOI: 10.1002/ANIE.202308004