Chlorine in PDB 5mx0: Crystal Structure of Human Fibromodulin

The structure of Crystal Structure of Human Fibromodulin, PDB code: 5mx0 was solved by P.Paracuellos, E.Hohenester, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	65.91 / 2.21
Space group	C 1 2 1
Cell size a, b, c (Å), α, β, γ (°)	108.110, 98.930, 111.340, 90.00, 107.39, 90.00
R / Rfree (%)	17.9 / 21.6

The structure of Crystal Structure of Human Fibromodulin also contains other interesting chemical elements:

Nickel

(Ni)

2 atoms

The binding sites of Chlorine atom in the Crystal Structure of Human Fibromodulin (pdb code 5mx0). 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 Human Fibromodulin, PDB code: 5mx0:
Jump to Chlorine binding site number: 1; 2;

Chlorine binding site 1 out of 2 in the Crystal Structure of Human Fibromodulin


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 Human Fibromodulin within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl517 b:67.6 occ:0.50 NI A:NI518 2.7 40.6 0.5 HD2 A:HIS209 3.7 68.0 1.0 HE2 A:HIS209 3.9 78.3 1.0 HE1 A:TYR232 4.3 48.4 1.0 CD2 A:HIS209 4.3 56.7 1.0 NE2 A:HIS209 4.4 65.3 1.0 CE1 A:TYR232 4.4 40.4 1.0 O A:HOH770 4.5 46.2 1.0 CZ A:TYR232 4.7 41.8 1.0 OH A:TYR232 4.8 48.0 1.0 CD1 A:TYR232 4.9 39.4 1.0

Chlorine binding site 2 out of 2 in the Crystal Structure of Human Fibromodulin


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 Human Fibromodulin within 5.0Å range: probe atom residue distance (Å) B Occ B:Cl517 b:60.0 occ:0.50 NI B:NI518 2.2 35.8 0.5 O B:HOH790 3.1 38.4 1.0 HE1 B:HIS185 3.6 49.9 1.0 ND1 B:HIS209 3.8 60.2 1.0 NE2 B:HIS185 3.9 37.4 1.0 HE1 B:HIS209 4.0 82.2 1.0 CE1 B:HIS185 4.1 41.6 1.0 CE1 B:HIS209 4.3 68.5 1.0 HG3 B:GLN208 4.4 47.0 1.0 HB2 B:HIS209 4.9 68.7 1.0

P.Paracuellos, S.Kalamajski, A.Bonna, D.Bihan, R.W.Farndale, E.Hohenester. Structural and Functional Analysis of Two Small Leucine-Rich Repeat Proteoglycans, Fibromodulin and Chondroadherin. Matrix Biol. V. 63 106 2017.
ISSN: ISSN 1569-1802
PubMed: 28215822
DOI: 10.1016/J.MATBIO.2017.02.002