Bromine in the structure of Crystal Structure Of the Catalytic Domain of Coagulation Factor XI in Complex With A Peptidomimetic Inhibitor (pdb 1zom)

The binding sites of Bromine atom in the structure of Crystal Structure Of the Catalytic Domain of Coagulation Factor XI in Complex With A Peptidomimetic Inhibitor (pdb code 1zom). This binding sites where shown with 5.0 Angstroms radius around Bromine atom. The 1zom structure was solved by J.LIN, H.DENG, L.JIN, P.PANDEY, M.RYNKIEWICZ, F.BIBBINS, S.CANTIN, J.QUINN, S.MAGEE, J.GORGA, with X-Ray Crystallography technique, brief refinement statistics is given in the table below: Resolution (A) 28.5-2.2 Space group I23 a (A) 120.932 b (A) 120.932 c (A) 120.932 alpha (°) 90.00 beta (°) 90.00 gamma (°) 90.00 Rfactor (%) n/a Rfree (%) n/a Bromine Binding Sites: Bromine binding site 1 out of 1 in 1zom Click to enlarge Click to enlarge Mono- and Stereo- picture of 5.0 Angstrom coordination sphere 1 of Bromine in the PDB 1zom. Coordination sphere was calculated for all residues within 5.0 Angstroms distance from the central Bromine atom, shown by VdW sphere Residues shown as a stick model or VDW spheres: A: Tyr143, A: Lys192, A: 3391001, A: Hoh1096, conact list: Atom Atom Distance (A) Br CE2 A:Tyr143 4.75 Br CZ A:Tyr143 4.85 Br OH A:Tyr143 4.67 Br CB A:Lys192 3.69 Br CD A:Lys192 4.36 Br CG A:Lys192 3.84 Br CA A:Lys192 4.92 Br C38 A:3391001 1.88 Br C11 A:3391001 3.88 Br C36 A:3391001 4.28 Br C35 A:3391001 4.81 Br C40 A:3391001 4.20 Br S12 A:3391001 3.94 Br BR41 A:3391001 0.00 Br C39 A:3391001 2.86 Br C37 A:3391001 2.93 Br O A:Hoh1096 3.46 interactive model: