Chlorine in PDB 3ir4: 1.2 Angstrom Crystal Structure of the Glutaredoxin 2 (Grxb) From Salmonella Typhimurium in Complex with Glutathione

The structure of 1.2 Angstrom Crystal Structure of the Glutaredoxin 2 (Grxb) From Salmonella Typhimurium in Complex with Glutathione, PDB code: 3ir4 was solved by G.Minasov, Z.Wawrzak, T.Skarina, O.Onopriyenko, S.N.Peterson, A.Halavaty, Z.Dauter, W.F.Anderson, Center For Structural Genomics Of Infectiousdiseases (Csgid), with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	27.87 / 1.20
Space group	P 21 21 21
Cell size a, b, c (Å), α, β, γ (°)	41.240, 58.760, 87.930, 90.00, 90.00, 90.00
R / Rfree (%)	11.7 / 14.4

The binding sites of Chlorine atom in the 1.2 Angstrom Crystal Structure of the Glutaredoxin 2 (Grxb) From Salmonella Typhimurium in Complex with Glutathione (pdb code 3ir4). 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 1.2 Angstrom Crystal Structure of the Glutaredoxin 2 (Grxb) From Salmonella Typhimurium in Complex with Glutathione, PDB code: 3ir4:

Chlorine binding site 1 out of 1 in the 1.2 Angstrom Crystal Structure of the Glutaredoxin 2 (Grxb) From Salmonella Typhimurium in Complex with Glutathione


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of 1.2 Angstrom Crystal Structure of the Glutaredoxin 2 (Grxb) From Salmonella Typhimurium in Complex with Glutathione within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl217 b:8.7 occ:0.70 O A:HOH547 3.2 10.0 1.0 O A:HOH657 3.3 17.1 1.0 NZ A:LYS14 3.3 6.2 1.0 O A:HOH538 3.3 12.0 1.0 CE A:LYS14 3.5 5.8 1.0 CB A:PRO10 3.8 4.1 1.0 CG A:PRO10 3.8 5.2 1.0 O A:HOH638 4.0 16.3 1.0 CE2 A:PHE11 4.2 8.8 1.0 CZ A:PHE11 4.3 10.1 1.0 O A:HOH575 4.4 11.4 1.0 ND2 A:ASN94 4.6 8.8 1.0 CD2 A:PHE11 4.7 6.4 1.0 CE1 A:PHE11 4.7 8.4 1.0 OD1 A:ASN94 4.7 10.9 1.0 O A:HOH708 4.8 19.5 1.0 CG A:ASN94 4.9 7.9 1.0 C A:PRO10 4.9 4.3 1.0 CA A:PRO10 4.9 4.7 1.0 CD A:LYS14 5.0 4.3 1.0 O A:HIS174 5.0 5.6 1.0

G.Minasov, Z.Wawrzak, T.Skarina, O.Onopriyenko, S.N.Peterson, A.Halavaty, Z.Dauter, W.F.Anderson, Center For Structural Genomics Of Infectious Diseases(Csgid). 1.2 Angstrom Crystal Structure of the Glutaredoxin 2 (Grxb) From Salmonella Typhimurium in Complex with Glutathione. To Be Published.