Chlorine in PDB 7rdp: Crystal Structure of Human Galectin-3 Crd in Complex with Selenodigalactoside

The structure of Crystal Structure of Human Galectin-3 Crd in Complex with Selenodigalactoside, PDB code: 7rdp was solved by C.Kishor, R.M.Go, H.Blanchard, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	30.86 / 1.96
Space group	P 21 21 21
Cell size a, b, c (Å), α, β, γ (°)	36.411, 58.034, 63.531, 90, 90, 90
R / Rfree (%)	15 / 18.3

The binding sites of Chlorine atom in the Crystal Structure of Human Galectin-3 Crd in Complex with Selenodigalactoside (pdb code 7rdp). 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 Human Galectin-3 Crd in Complex with Selenodigalactoside, PDB code: 7rdp:

Chlorine binding site 1 out of 1 in the Crystal Structure of Human Galectin-3 Crd in Complex with Selenodigalactoside


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 Galectin-3 Crd in Complex with Selenodigalactoside within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl302 b:20.2 occ:1.00 O A:HOH441 3.0 27.3 1.0 O A:HOH460 3.1 20.1 1.0 N A:LYS226 3.2 13.3 1.0 N A:LYS227 3.5 12.8 1.0 CG A:LYS227 3.9 17.8 1.0 CA A:LYS226 4.0 14.4 1.0 CG1 A:VAL225 4.0 14.2 1.0 C A:VAL225 4.0 14.0 1.0 CA A:VAL225 4.1 13.2 1.0 CD A:LYS227 4.1 21.0 1.0 CB A:LYS227 4.1 15.1 1.0 C A:LYS226 4.2 14.1 1.0 CB A:LYS226 4.2 16.7 1.0 NH1 A:ARG151 4.3 15.6 1.0 CA A:LYS227 4.5 14.3 1.0 CB A:VAL225 4.6 13.3 1.0 O A:HOH440 4.6 29.1 1.0 CZ A:ARG151 4.6 15.5 1.0 CE A:LYS227 4.7 23.1 1.0 O A:HOH428 4.8 13.5 1.0 NE A:ARG151 4.9 14.0 1.0

M.Raics, A.K.Balogh, C.Kishor, I.Timari, F.J.Medrano, A.Romero, R.M.Go, H.Blanchard, L.Szilagyi, K.E Kover, K.Feher. Investigation of the Molecular Details of the Interactions of Selenoglycosides and Human Galectin-3. Int J Mol Sci V. 23 2022.
ISSN: ESSN 1422-0067
PubMed: 35269646
DOI: 10.3390/IJMS23052494