Chlorine in PDB 5v5z: Structure of CYP51 From the Pathogen Candida Albicans

All present enzymatic activity of Structure of CYP51 From the Pathogen Candida Albicans:
1.14.13.70;

The structure of Structure of CYP51 From the Pathogen Candida Albicans, PDB code: 5v5z was solved by M.V.Keniya, M.Sabherwal, R.K.Wilson, A.A.Sagatova, J.D.A.Tyndall, B.C.Monk, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	44.51 / 2.90
Space group	P 2 21 21
Cell size a, b, c (Å), α, β, γ (°)	91.940, 92.510, 101.530, 90.00, 90.00, 90.00
R / Rfree (%)	21.9 / 26.9

The structure of Structure of CYP51 From the Pathogen Candida Albicans also contains other interesting chemical elements:

Iron

(Fe)

1 atom

The binding sites of Chlorine atom in the Structure of CYP51 From the Pathogen Candida Albicans (pdb code 5v5z). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 2 binding sites of Chlorine where determined in the Structure of CYP51 From the Pathogen Candida Albicans, PDB code: 5v5z:
Jump to Chlorine binding site number: 1; 2;

Chlorine binding site 1 out of 2 in the Structure of CYP51 From the Pathogen Candida Albicans


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Structure of CYP51 From the Pathogen Candida Albicans within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl602 b:60.7 occ:1.00 CL8 A:1YN602 0.0 60.7 1.0 C45 A:1YN602 1.7 63.7 1.0 C44 A:1YN602 2.7 66.4 1.0 C46 A:1YN602 2.7 59.8 1.0 CD1 A:ILE131 3.4 52.2 1.0 N A:ILE304 3.6 48.3 1.0 C A:GLY303 3.6 49.6 1.0 CG2 A:ILE131 3.8 55.0 1.0 CG1 A:ILE131 3.9 49.1 1.0 CMD A:HEM601 4.0 38.7 1.0 C43 A:1YN602 4.0 57.8 1.0 CA A:ILE304 4.0 46.7 1.0 C47 A:1YN602 4.0 61.9 1.0 O A:GLY303 4.0 54.1 1.0 CA A:GLY303 4.1 48.9 1.0 CG1 A:ILE304 4.2 49.6 1.0 CD1 A:LEU300 4.4 42.7 1.0 CB A:ILE131 4.5 60.3 1.0 C42 A:1YN602 4.5 56.7 1.0 C2D A:HEM601 4.7 54.6 1.0 CB A:ILE304 4.7 50.0 1.0 O A:LEU300 4.9 48.0 1.0 CHD A:HEM601 5.0 44.1 1.0 CE2 A:PHE126 5.0 64.5 1.0

Chlorine binding site 2 out of 2 in the Structure of CYP51 From the Pathogen Candida Albicans


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of Structure of CYP51 From the Pathogen Candida Albicans within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl602 b:96.1 occ:1.00 CL9 A:1YN602 0.0 96.1 1.0 C43 A:1YN602 1.7 57.8 1.0 C44 A:1YN602 2.6 66.4 1.0 C42 A:1YN602 2.7 56.7 1.0 O33 A:1YN602 3.0 61.7 1.0 C34 A:1YN602 3.1 56.5 1.0 C36 A:1YN602 3.2 50.1 1.0 CA A:GLY307 3.4 46.1 1.0 N41 A:1YN602 3.8 55.3 1.0 N37 A:1YN602 3.8 54.4 1.0 CZ A:PHE126 3.8 66.8 1.0 CZ A:PHE228 3.9 69.2 1.0 C45 A:1YN602 3.9 63.7 1.0 N A:GLY307 4.0 52.5 1.0 C47 A:1YN602 4.0 61.9 1.0 CE2 A:PHE126 4.1 64.5 1.0 C32 A:1YN602 4.3 63.5 1.0 C46 A:1YN602 4.5 59.8 1.0 O35 A:1YN602 4.6 54.2 1.0 CE1 A:PHE228 4.6 68.1 1.0 O A:GLY303 4.7 54.1 1.0 CE2 A:PHE228 4.7 67.9 1.0 C A:GLY307 4.7 50.6 1.0 C40 A:1YN602 4.9 50.7 1.0 C38 A:1YN602 5.0 51.1 1.0 C A:MET306 5.0 57.5 1.0 CG2 A:THR122 5.0 67.9 1.0

M.V.Keniya, M.Sabherwal, R.K.Wilson, A.A.Sagatova, M.A.Woods, F.U.Huschmann, J.D.A.Tyndall, B.C.Monk. Structures of CYP51 From the Pathogens Candida Glabrata and Candida Albicans To Be Published.