Chlorine in PDB 5icr: 2.25 Angstrom Resolution Crystal Structure of Fatty-Acid-Coa Ligase (FADD32) From Mycobacterium Smegmatis in Complex with Inhibitor 5'-O- [(11-Phenoxyundecanoyl)Sulfamoyl]Adenosine.

The structure of 2.25 Angstrom Resolution Crystal Structure of Fatty-Acid-Coa Ligase (FADD32) From Mycobacterium Smegmatis in Complex with Inhibitor 5'-O- [(11-Phenoxyundecanoyl)Sulfamoyl]Adenosine., PDB code: 5icr was solved by G.Minasov, L.Shuvalova, D.Hung, S.L.Fisher, J.Edelstein, O.Kiryukhina, I.Dubrovska, W.F.Anderson, Center For Structural Genomics Ofinfectious Diseases (Csgid), with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	29.86 / 2.25
Space group	P 21 21 21
Cell size a, b, c (Å), α, β, γ (°)	90.294, 153.561, 201.253, 90.00, 90.00, 90.00
R / Rfree (%)	17.3 / 21.9

The binding sites of Chlorine atom in the 2.25 Angstrom Resolution Crystal Structure of Fatty-Acid-Coa Ligase (FADD32) From Mycobacterium Smegmatis in Complex with Inhibitor 5'-O- [(11-Phenoxyundecanoyl)Sulfamoyl]Adenosine. (pdb code 5icr). 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 2.25 Angstrom Resolution Crystal Structure of Fatty-Acid-Coa Ligase (FADD32) From Mycobacterium Smegmatis in Complex with Inhibitor 5'-O- [(11-Phenoxyundecanoyl)Sulfamoyl]Adenosine., PDB code: 5icr:

Chlorine binding site 1 out of 1 in the 2.25 Angstrom Resolution Crystal Structure of Fatty-Acid-Coa Ligase (FADD32) From Mycobacterium Smegmatis in Complex with Inhibitor 5'-O- [(11-Phenoxyundecanoyl)Sulfamoyl]Adenosine.


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of 2.25 Angstrom Resolution Crystal Structure of Fatty-Acid-Coa Ligase (FADD32) From Mycobacterium Smegmatis in Complex with Inhibitor 5'-O- [(11-Phenoxyundecanoyl)Sulfamoyl]Adenosine. within 5.0Å range: probe atom residue distance (Å) B Occ B:Cl702 b:79.2 occ:1.00 O B:HOH1002 4.0 36.9 0.5 CB B:SER19 4.1 86.6 1.0 CB B:ALA205 4.2 37.9 1.0 N B:SER20 4.3 79.1 1.0 C B:SER19 4.3 83.3 1.0 O B:SER19 4.4 84.8 1.0 CG B:PHE15 4.4 64.6 1.0 CA B:SER20 4.5 76.4 1.0 CD2 B:PHE15 4.5 61.0 1.0 CB B:PHE15 4.6 70.8 1.0 C B:SER20 4.6 71.1 1.0 CG1 B:ILE21 4.7 60.1 1.0 N B:ILE21 4.7 64.8 1.0 O B:HIS201 4.7 35.1 1.0 CD1 B:PHE15 4.8 62.3 1.0 CA B:SER19 4.9 87.1 1.0

G.Minasov, L.Shuvalova, D.Hung, S.L.Fisher, J.Edelstein, O.Kiryukhina, I.Dubrovska, W.F.Anderson, Center For Structural Genomics Of Infectious Diseases(Csgid). 2.25 Angstrom Resolution Crystal Structure of Fatty-Acid-Coa Ligase (FADD32) From Mycobacterium Smegmatis in Complex with Inhibitor 5'-O-[(11-Phenoxyundecanoyl)Sulfamoyl]Adenosine. To Be Published.