Chlorine in PDB 4rk2: Crystal Structure of Sugar Transporter RHE_PF00321 From Rhizobium Etli, Target Efi-510806, An Open Conformation

The structure of Crystal Structure of Sugar Transporter RHE_PF00321 From Rhizobium Etli, Target Efi-510806, An Open Conformation, PDB code: 4rk2 was solved by Y.Patskovsky, R.Toro, R.Bhosle, N.Al Obaidi, S.Chamala, J.D.Attonito, A.Scott Glenn, S.Chowdhury, J.Lafleur, R.D.Siedel, B.Hillerich, J.Love, K.L.Whalen, J.A.Gerlt, S.C.Almo, Enzyme Function Initiative (Efi), with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	50.00 / 1.80
Space group	P 21 21 21
Cell size a, b, c (Å), α, β, γ (°)	51.995, 110.520, 137.276, 90.00, 90.00, 90.00
R / Rfree (%)	18.3 / 24.3

The binding sites of Chlorine atom in the Crystal Structure of Sugar Transporter RHE_PF00321 From Rhizobium Etli, Target Efi-510806, An Open Conformation (pdb code 4rk2). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 2 binding sites of Chlorine where determined in the Crystal Structure of Sugar Transporter RHE_PF00321 From Rhizobium Etli, Target Efi-510806, An Open Conformation, PDB code: 4rk2:
Jump to Chlorine binding site number: 1; 2;

Chlorine binding site 1 out of 2 in the Crystal Structure of Sugar Transporter RHE_PF00321 From Rhizobium Etli, Target Efi-510806, An Open Conformation


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Crystal Structure of Sugar Transporter RHE_PF00321 From Rhizobium Etli, Target Efi-510806, An Open Conformation within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl501 b:50.7 occ:1.00 N A:ILE308 3.2 31.6 1.0 N A:VAL97 3.4 30.3 1.0 O A:HOH624 3.5 35.9 1.0 CA A:GLN307 3.6 32.2 1.0 O A:ILE308 3.7 38.2 1.0 CG2 A:VAL97 3.7 40.2 1.0 CB A:ASP96 3.8 35.3 1.0 CB A:GLN307 3.8 33.8 1.0 CA A:ASP96 3.8 35.0 1.0 C A:GLN307 3.9 38.4 1.0 O A:HOH753 4.0 50.2 1.0 C A:ASP96 4.1 33.3 1.0 CG1 A:ILE308 4.2 38.2 1.0 CG A:GLN307 4.2 37.3 1.0 CA A:ILE308 4.3 30.1 1.0 CB A:VAL97 4.3 35.3 1.0 C A:ILE308 4.4 32.8 1.0 CA A:VAL97 4.4 30.1 1.0 CB A:ILE308 4.8 33.3 1.0 OE1 A:GLN307 5.0 48.1 1.0 N A:GLN307 5.0 27.0 1.0

Chlorine binding site 2 out of 2 in the Crystal Structure of Sugar Transporter RHE_PF00321 From Rhizobium Etli, Target Efi-510806, An Open Conformation


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of Crystal Structure of Sugar Transporter RHE_PF00321 From Rhizobium Etli, Target Efi-510806, An Open Conformation within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl502 b:58.5 occ:1.00 O A:HOH892 3.3 59.2 1.0 N A:ALA173 3.4 45.2 1.0 N A:TRP172 3.5 36.8 1.0 CB A:TRP172 3.8 44.7 1.0 CA A:TRP172 4.0 39.4 1.0 CB A:THR171 4.0 38.1 1.0 N A:ASP297 4.1 45.2 1.0 C A:TRP172 4.1 47.8 1.0 CB A:ALA173 4.1 48.5 1.0 CA A:PRO296 4.2 47.0 1.0 CA A:ALA173 4.3 44.7 1.0 O A:HIS295 4.4 42.8 1.0 C A:THR171 4.4 33.5 1.0 OG1 A:THR171 4.5 39.6 1.0 C A:PRO296 4.6 49.1 1.0 CA A:THR171 4.7 34.2 1.0 CH2 A:TRP226 4.7 42.4 1.0 CG A:TRP172 4.9 42.4 1.0 CG2 A:THR171 4.9 43.0 1.0

Y.Patskovsky, R.Toro, R.Bhosle, N.Al Obaidi, S.Chamala, A.Scott Glenn, J.D.Attonito, S.Chowdhury, J.Lafleur, R.D.Siedel, B.Hillerich, J.Love, K.L.Whalen, J.A.Gerlt, S.C.Almo, Enzyme Function Initiative (Efi). Crystal Structure of Sugar Transporter RHE_PF00321 From Rhizobium Etli, Target Efi-510806 To Be Published.