Chlorine in PDB 6g0v: Human Galectin-3 in Complex with A Tf Tumor-Associated Antigen Mimetic

The structure of Human Galectin-3 in Complex with A Tf Tumor-Associated Antigen Mimetic, PDB code: 6g0v was solved by F.G.Trovao, S.Santarsia, A.L.Carvalho, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	42.68 / 1.09
Space group	P 21 21 21
Cell size a, b, c (Å), α, β, γ (°)	35.900, 58.200, 62.760, 90.00, 90.00, 90.00
R / Rfree (%)	15.3 / 17.7

The binding sites of Chlorine atom in the Human Galectin-3 in Complex with A Tf Tumor-Associated Antigen Mimetic (pdb code 6g0v). 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 Human Galectin-3 in Complex with A Tf Tumor-Associated Antigen Mimetic, PDB code: 6g0v:

Chlorine binding site 1 out of 1 in the Human Galectin-3 in Complex with A Tf Tumor-Associated Antigen Mimetic


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Human Galectin-3 in Complex with A Tf Tumor-Associated Antigen Mimetic within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl302 b:12.6 occ:1.00 H A:LYS226 2.4 11.4 1.0 H A:LYS227 2.7 11.1 1.0 HG13 A:VAL225 3.1 12.9 1.0 HG3 A:LYS227 3.1 15.8 1.0 O A:HOH592 3.2 11.8 1.0 N A:LYS226 3.2 9.5 1.0 HB2 A:LYS226 3.2 14.8 1.0 HD2 A:LYS227 3.3 17.2 1.0 HA A:VAL225 3.4 11.5 1.0 N A:LYS227 3.4 9.2 1.0 HB2 A:LYS227 3.5 12.7 1.0 CG A:LYS227 3.8 13.2 1.0 CG1 A:VAL225 3.9 10.8 1.0 CA A:LYS226 3.9 10.2 1.0 CB A:LYS226 3.9 12.3 1.0 HG12 A:VAL225 3.9 12.9 1.0 CD A:LYS227 3.9 14.3 1.0 HG2 A:LYS226 4.0 15.2 1.0 CB A:LYS227 4.0 10.6 1.0 C A:VAL225 4.0 10.3 1.0 CA A:VAL225 4.1 9.6 1.0 HE3 A:LYS227 4.1 18.4 1.0 C A:LYS226 4.1 9.9 1.0 CA A:LYS227 4.3 10.8 1.0 HH11 A:ARG151 4.4 14.9 1.0 NH1 A:ARG151 4.4 12.4 1.0 CG A:LYS226 4.4 12.7 1.0 CZ A:ARG151 4.5 10.6 1.0 HD3 A:ARG151 4.5 12.2 1.0 CB A:VAL225 4.5 10.3 1.0 CE A:LYS227 4.5 15.3 1.0 HG22 A:VAL225 4.6 13.3 1.0 HH12 A:ARG151 4.6 14.9 1.0 HZ2 A:LYS227 4.6 18.9 1.0 HG11 A:VAL225 4.6 12.9 1.0 O A:HOH486 4.6 15.2 1.0 HG2 A:LYS227 4.6 15.8 1.0 O A:HOH458 4.7 11.8 1.0 NE A:ARG151 4.7 10.1 1.0 HB3 A:LYS226 4.7 14.8 1.0 HD3 A:LYS227 4.8 17.2 1.0 HG3 A:LYS226 4.8 15.2 1.0 HD2 A:ARG151 4.8 12.2 1.0 HA A:LYS226 4.8 12.2 1.0 O A:HOH599 4.9 34.5 1.0 HB3 A:LYS227 4.9 12.7 1.0 CD A:ARG151 4.9 10.2 1.0 HA A:LYS227 5.0 13.0 1.0

S.Santarsia, A.S.Grosso, F.Trovao, J.Jimenez-Barbero, A.L.Carvalho, C.Nativi, F.Marcelo. Molecular Recognition of A Thomsen-Friedenreich Antigen Mimetic Targeting Human Galectin-3. Chemmedchem V. 13 2030 2018.
ISSN: ESSN 1860-7187
PubMed: 30094951
DOI: 10.1002/CMDC.201800525