Chlorine in PDB 4i1y: The Structure of Cysteine Synthase From Mycobacterium Ulcerans AGY99

All present enzymatic activity of The Structure of Cysteine Synthase From Mycobacterium Ulcerans AGY99:
2.5.1.47;

The structure of The Structure of Cysteine Synthase From Mycobacterium Ulcerans AGY99, PDB code: 4i1y was solved by Seattle Structural Genomics Center For Infectious Disease (Ssgcid), with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	48.71 / 2.60
Space group	P 1
Cell size a, b, c (Å), α, β, γ (°)	58.965, 77.900, 87.101, 114.21, 104.86, 94.37
R / Rfree (%)	26.1 / 29.4

The binding sites of Chlorine atom in the The Structure of Cysteine Synthase From Mycobacterium Ulcerans AGY99 (pdb code 4i1y). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 3 binding sites of Chlorine where determined in the The Structure of Cysteine Synthase From Mycobacterium Ulcerans AGY99, PDB code: 4i1y:
Jump to Chlorine binding site number: 1; 2; 3;

Chlorine binding site 1 out of 3 in the The Structure of Cysteine Synthase From Mycobacterium Ulcerans AGY99


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of The Structure of Cysteine Synthase From Mycobacterium Ulcerans AGY99 within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl401 b:0.3 occ:1.00 NH2 A:ARG194 3.9 67.8 1.0 CD A:LYS169 4.1 67.2 1.0 NH1 A:ARG194 4.2 67.7 1.0 NZ A:LYS169 4.4 68.2 1.0 CE A:LYS169 4.4 67.9 1.0 CZ A:ARG194 4.6 67.3 1.0

Chlorine binding site 2 out of 3 in the The Structure of Cysteine Synthase From Mycobacterium Ulcerans AGY99


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of The Structure of Cysteine Synthase From Mycobacterium Ulcerans AGY99 within 5.0Å range: probe atom residue distance (Å) B Occ B:Cl401 b:0.3 occ:1.00 NH1 B:ARG18 2.9 69.3 1.0 OD2 B:ASP29 3.2 72.1 1.0 CG B:ASP29 4.0 71.3 1.0 SD C:MET1 4.2 71.9 1.0 CZ B:ARG18 4.2 68.7 1.0 CB B:ASP29 4.3 69.6 1.0 CE C:MET1 4.5 73.7 1.0 CD1 B:LEU287 4.5 62.7 1.0 NH2 B:ARG18 4.8 68.6 1.0 CD2 B:LEU287 4.8 62.5 1.0 OD1 B:ASP29 4.9 72.2 1.0

Chlorine binding site 3 out of 3 in the The Structure of Cysteine Synthase From Mycobacterium Ulcerans AGY99


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 3 of The Structure of Cysteine Synthase From Mycobacterium Ulcerans AGY99 within 5.0Å range: probe atom residue distance (Å) B Occ C:Cl401 b:0.3 occ:1.00 NH2 C:ARG194 4.2 72.8 1.0 NH1 C:ARG194 4.3 72.3 1.0 CZ C:ARG194 4.8 71.7 1.0

L.Baugh, I.Phan, D.W.Begley, M.C.Clifton, B.Armour, D.M.Dranow, B.M.Taylor, M.M.Muruthi, J.Abendroth, J.W.Fairman, D.Fox, S.H.Dieterich, B.L.Staker, A.S.Gardberg, R.Choi, S.N.Hewitt, A.J.Napuli, J.Myers, L.K.Barrett, Y.Zhang, M.Ferrell, E.Mundt, K.Thompkins, N.Tran, S.Lyons-Abbott, A.Abramov, A.Sekar, D.Serbzhinskiy, D.Lorimer, G.W.Buchko, R.Stacy, L.J.Stewart, T.E.Edwards, W.C.Van Voorhis, P.J.Myler. Increasing the Structural Coverage of Tuberculosis Drug Targets. Tuberculosis (Edinb) V. 95 142 2015.
ISSN: ISSN 1472-9792
PubMed: 25613812
DOI: 10.1016/J.TUBE.2014.12.003