Iodine in PDB 6i3g: Crystal Structure of A Putative Peptide Binding Protein Appa From Clostridium Difficile

The structure of Crystal Structure of A Putative Peptide Binding Protein Appa From Clostridium Difficile, PDB code: 6i3g was solved by A.M.Hughes, A.Wilkinson, E.Dodson, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	54.82 / 2.00
Space group	P 21 21 21
Cell size a, b, c (Å), α, β, γ (°)	45.525, 106.094, 109.515, 90.00, 90.00, 90.00
R / Rfree (%)	20.5 / 26.5

The binding sites of Iodine atom in the Crystal Structure of A Putative Peptide Binding Protein Appa From Clostridium Difficile (pdb code 6i3g). This binding sites where shown within 5.0 Angstroms radius around Iodine atom.
In total only one binding site of Iodine was determined in the Crystal Structure of A Putative Peptide Binding Protein Appa From Clostridium Difficile, PDB code: 6i3g:

Iodine binding site 1 out of 1 in the Crystal Structure of A Putative Peptide Binding Protein Appa From Clostridium Difficile


Mono view


Stereo pair view

A full contact list of Iodine with other atoms in the I binding site number 1 of Crystal Structure of A Putative Peptide Binding Protein Appa From Clostridium Difficile within 5.0Å range: probe atom residue distance (Å) B Occ A:I501 b:46.7 occ:0.50 ND2 A:ASN100 3.6 30.1 1.0 O A:HOH809 3.6 49.1 1.0 CA A:PHE97 3.6 29.6 1.0 N A:PHE97 4.0 29.0 1.0 CD1 A:PHE97 4.1 35.0 1.0 CB A:PHE97 4.1 30.8 1.0 CE A:LYS155 4.1 40.6 1.0 NZ A:LYS155 4.2 44.1 1.0 CB A:ASN100 4.2 30.8 1.0 CG A:ASN100 4.4 31.9 1.0 C A:LEU96 4.4 29.2 1.0 O A:LEU96 4.6 28.3 1.0 CG A:LEU96 4.6 36.5 1.0 CG A:PHE97 4.6 32.1 1.0 CD2 A:LEU96 4.8 35.6 1.0 C A:PHE97 4.8 30.2 1.0 O A:PHE97 4.9 30.8 1.0

A.Hughes, S.Wilson, E.J.Dodson, J.P.Turkenburg, A.J.Wilkinson. Crystal Structure of the Putative Peptide-Binding Protein Appa From Clostridium Difficile. Acta Crystallogr.,Sect.F V. 75 246 2019.
ISSN: ESSN 2053-230X
PubMed: 30950825
DOI: 10.1107/S2053230X1900178X