Chlorine in PDB 4n17: Crystal Structure of A Trap Periplasmic Solute Binding Protein From Burkholderia Ambifaria (BAM_6123), Target Efi-510059, with Bound Beta-D-Galacturonate

The structure of Crystal Structure of A Trap Periplasmic Solute Binding Protein From Burkholderia Ambifaria (BAM_6123), Target Efi-510059, with Bound Beta-D-Galacturonate, PDB code: 4n17 was solved by M.W.Vetting, R.Toro, R.Bhosle, N.F.Al Obaidi, S.Zhao, M.Stead, J.D.Attonito, A.Scott Glenn, S.Chowdhury, B.Evans, B.Hillerich, J.Love, R.D.Seidel, H.J.Imker, M.P.Jacobson, J.A.Gerlt, S.C.Almo, Enzyme Functioninitiative (Efi), with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	24.41 / 1.50
Space group	C 2 2 21
Cell size a, b, c (Å), α, β, γ (°)	96.152, 101.369, 55.720, 90.00, 90.00, 90.00
R / Rfree (%)	17 / 20.2

The structure of Crystal Structure of A Trap Periplasmic Solute Binding Protein From Burkholderia Ambifaria (BAM_6123), Target Efi-510059, with Bound Beta-D-Galacturonate also contains other interesting chemical elements:

Calcium

(Ca)

2 atoms

The binding sites of Chlorine atom in the Crystal Structure of A Trap Periplasmic Solute Binding Protein From Burkholderia Ambifaria (BAM_6123), Target Efi-510059, with Bound Beta-D-Galacturonate (pdb code 4n17). 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 Crystal Structure of A Trap Periplasmic Solute Binding Protein From Burkholderia Ambifaria (BAM_6123), Target Efi-510059, with Bound Beta-D-Galacturonate, PDB code: 4n17:

Chlorine binding site 1 out of 1 in the Crystal Structure of A Trap Periplasmic Solute Binding Protein From Burkholderia Ambifaria (BAM_6123), Target Efi-510059, with Bound Beta-D-Galacturonate


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 A Trap Periplasmic Solute Binding Protein From Burkholderia Ambifaria (BAM_6123), Target Efi-510059, with Bound Beta-D-Galacturonate within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl402 b:12.5 occ:1.00 H A:GLU73 2.4 14.1 1.0 H A:PHE192 2.4 12.8 1.0 HG3 A:GLU73 2.8 22.6 1.0 HB2 A:SER72 3.0 19.6 1.0 HA A:PRO191 3.0 13.8 1.0 O A:HOH557 3.1 19.5 1.0 O A:HOH525 3.1 12.9 1.0 O A:HOH528 3.1 11.4 1.0 N A:GLU73 3.2 11.8 1.0 N A:PHE192 3.2 10.6 1.0 HG11 A:VAL34 3.3 12.3 1.0 HB3 A:PRO191 3.3 19.7 1.0 HB2 A:PHE192 3.4 12.7 1.0 HA A:SER72 3.4 12.8 1.0 HB2 A:GLU73 3.6 15.1 1.0 HB3 A:PHE192 3.6 12.7 1.0 CG A:GLU73 3.7 18.8 1.0 CA A:PRO191 3.7 11.5 1.0 CB A:SER72 3.9 16.4 1.0 CB A:PHE192 3.9 10.6 1.0 CA A:SER72 3.9 10.7 1.0 HG2 A:GLU73 4.0 22.6 1.0 CB A:GLU73 4.0 12.6 1.0 CB A:PRO191 4.0 16.4 1.0 C A:PRO191 4.0 6.4 1.0 C A:SER72 4.0 10.5 1.0 HG12 A:VAL34 4.1 12.3 1.0 CG1 A:VAL34 4.1 10.2 1.0 CA A:GLU73 4.1 11.8 1.0 CA A:PHE192 4.2 11.5 1.0 H A:ALA193 4.3 13.4 1.0 H A:LYS74 4.3 15.4 1.0 HB3 A:SER72 4.3 19.6 1.0 O A:HOH684 4.4 26.4 1.0 HB2 A:PRO191 4.5 19.7 1.0 HG13 A:VAL34 4.6 12.3 1.0 HH21 A:ARG169 4.7 8.8 1.0 HA A:GLU73 4.8 14.2 1.0 O61 A:GTR401 4.8 9.0 1.0 CD A:GLU73 4.8 7.7 1.0 HA A:PHE192 4.8 13.8 1.0 HG A:SER68 4.8 12.7 1.0 HH22 A:ARG169 4.9 8.8 1.0 OG A:SER72 4.9 15.7 1.0 HB3 A:GLU73 4.9 15.1 1.0 N A:ALA193 4.9 11.2 1.0 HG3 A:PRO191 4.9 23.1 1.0 O A:HOH573 4.9 16.9 1.0 O A:HOH627 5.0 21.3 1.0 N A:LYS74 5.0 12.9 1.0

M.W.Vetting, R.Toro, R.Bhosle, N.F.Al Obaidi, S.Zhao, M.Stead, J.D.Attonito, A.Scott Glenn, S.Chowdhury, B.Evans, B.Hillerich, J.Love, R.D.Seidel, H.J.Imker, M.P.Jacobson, J.A.Gerlt, S.C.Almo. Crystal Structure of A Trap Periplasmic Solute Binding Protein From Burkholderia Ambifaria (BAM_6123), Target Efi-510059, with Bound Beta-D-Galacturonate To Be Published.