Iodine in PDB 5jrv: Crystal Structure of Fe(II) No-Bound H-Nox Protein From C. Subterraneus

The structure of Crystal Structure of Fe(II) No-Bound H-Nox Protein From C. Subterraneus, PDB code: 5jrv was solved by J.Bruegger, C.Hespen, C.M.Phillips-Piro, M.A.Marletta, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	49.98 / 1.95
Space group	P 21 21 2
Cell size a, b, c (Å), α, β, γ (°)	80.385, 127.626, 42.937, 90.00, 90.00, 90.00
R / Rfree (%)	20.2 / 23.1

The structure of Crystal Structure of Fe(II) No-Bound H-Nox Protein From C. Subterraneus also contains other interesting chemical elements:

Iron

(Fe)

2 atoms

The binding sites of Iodine atom in the Crystal Structure of Fe(II) No-Bound H-Nox Protein From C. Subterraneus (pdb code 5jrv). 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 Fe(II) No-Bound H-Nox Protein From C. Subterraneus, PDB code: 5jrv:

Iodine binding site 1 out of 1 in the Crystal Structure of Fe(II) No-Bound H-Nox Protein From C. Subterraneus


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 Fe(II) No-Bound H-Nox Protein From C. Subterraneus within 5.0Å range: probe atom residue distance (Å) B Occ B:I203 b:31.4 occ:1.00 OG1 B:THR4 3.4 27.3 1.0 NZ B:LYS2 3.4 24.5 1.0 O A:HOH317 3.6 38.1 1.0 CZ B:PHE82 4.1 31.8 1.0 CB B:THR4 4.1 31.1 1.0 CE B:LYS2 4.2 26.9 1.0 CE2 B:PHE82 4.2 32.6 1.0 CZ3 B:TRP81 4.3 35.6 1.0 CG2 B:THR4 4.4 31.8 1.0 CD1 B:LEU105 4.4 28.7 1.0 CD B:LYS2 4.5 29.6 1.0 CE3 B:TRP81 4.5 34.7 1.0 CMA B:HEM201 4.5 29.8 1.0 CB A:SER84 4.6 34.0 1.0 OG A:SER84 4.6 33.4 1.0 CD2 B:LEU105 4.6 26.8 1.0 CB B:LEU105 4.7 26.3 1.0 CD1 B:ILE5 4.7 28.3 1.0 O A:HOH348 4.8 35.0 1.0 CG B:LEU105 4.8 29.9 1.0

C.W.Hespen, J.J.Bruegger, C.M.Phillips-Piro, M.A.Marletta. Structural and Functional Evidence Indicates Selective Oxygen Signaling in Caldanaerobacter Subterraneus H-Nox. Acs Chem.Biol. V. 11 2337 2016.
ISSN: ESSN 1554-8937
PubMed: 27328180
DOI: 10.1021/ACSCHEMBIO.6B00431