Chlorine in PDB 7als: Alpha and Beta Lactose Isomer Structure of Galectin 8, N-Terminal Domain

The structure of Alpha and Beta Lactose Isomer Structure of Galectin 8, N-Terminal Domain, PDB code: 7als was solved by M.Hakansson, B.Walse, C.Diehl, R.Kovacic, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	41.15 / 1.35
Space group	P 21 21 21
Cell size a, b, c (Å), α, β, γ (°)	54.56, 62.54, 84.65, 90, 90, 90
R / Rfree (%)	14.9 / 19.9

The binding sites of Chlorine atom in the Alpha and Beta Lactose Isomer Structure of Galectin 8, N-Terminal Domain (pdb code 7als). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 3 binding sites of Chlorine where determined in the Alpha and Beta Lactose Isomer Structure of Galectin 8, N-Terminal Domain, PDB code: 7als:
Jump to Chlorine binding site number: 1; 2; 3;

Chlorine binding site 1 out of 3 in the Alpha and Beta Lactose Isomer Structure of Galectin 8, N-Terminal Domain


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Alpha and Beta Lactose Isomer Structure of Galectin 8, N-Terminal Domain within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl201 b:25.1 occ:1.00 NZ A:LYS113 3.1 33.1 1.0 N B:GLY131 3.2 18.9 1.0 N A:ASP112 3.3 20.1 1.0 O B:HOH360 3.3 31.7 1.0 CB A:ASP112 3.6 27.4 1.0 NZ B:LYS134 3.7 64.4 1.0 CB A:LEU110 3.9 17.9 1.0 N A:LYS111 3.9 19.4 1.0 CA A:ASP112 3.9 20.9 1.0 CA B:GLY131 4.0 20.1 1.0 C B:ILE130 4.0 18.3 1.0 CA B:ILE130 4.0 18.3 1.0 CB A:LYS111 4.0 22.4 1.0 C A:LYS111 4.2 20.4 1.0 CE A:LYS113 4.2 32.1 1.0 CG2 B:ILE130 4.2 22.8 1.0 CA A:LYS111 4.3 21.0 1.0 CG A:LYS113 4.3 23.4 1.0 CG A:ASP112 4.3 35.0 1.0 OD2 A:ASP112 4.4 44.4 1.0 N A:LYS113 4.4 19.9 1.0 C A:LEU110 4.5 21.3 1.0 C A:ASP112 4.5 21.1 1.0 CD1 A:LEU110 4.6 22.1 1.0 CG B:LYS134 4.6 30.5 1.0 CB B:ILE130 4.7 20.6 1.0 CE B:LYS134 4.8 47.7 1.0 CA A:LEU110 4.8 21.8 1.0 OE2 B:GLU133 4.8 26.2 1.0 CD A:LYS113 4.8 24.4 1.0 CG A:LEU110 4.9 19.3 1.0 O B:ARG129 4.9 20.3 1.0

Chlorine binding site 2 out of 3 in the Alpha and Beta Lactose Isomer Structure of Galectin 8, N-Terminal Domain


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of Alpha and Beta Lactose Isomer Structure of Galectin 8, N-Terminal Domain within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl202 b:29.6 occ:1.00 O3 F:GAL2 2.8 24.2 0.5 O3 E:GAL2 2.9 24.2 0.5 NH2 A:ARG59 3.1 24.2 1.0 NE2 A:GLN47 3.2 20.2 1.0 NH1 A:ARG59 3.5 28.2 1.0 CZ A:ARG59 3.7 24.9 1.0 C3 F:GAL2 3.7 24.1 0.5 CZ2 A:TRP86 3.8 22.0 1.0 C3 E:GAL2 3.8 24.1 0.5 O A:HOH400 3.9 38.7 1.0 OE1 A:GLN47 3.9 21.2 1.0 O A:HOH365 3.9 35.6 1.0 CD A:GLN47 4.0 18.8 1.0 NH2 A:ARG45 4.1 23.2 1.0 CE1 A:HIS65 4.1 19.3 1.0 C4 F:GAL2 4.1 20.5 0.5 C4 E:GAL2 4.2 21.3 0.5 O4 F:GAL2 4.5 20.4 0.5 CH2 A:TRP86 4.5 20.2 1.0 O A:HOH427 4.5 45.1 1.0 CE2 A:TRP86 4.7 22.7 1.0 NE2 A:HIS65 4.7 18.5 1.0 O4 E:GAL2 4.7 20.3 0.5 ND1 A:HIS65 4.8 17.1 1.0 NE1 A:TRP86 4.8 23.9 1.0

Chlorine binding site 3 out of 3 in the Alpha and Beta Lactose Isomer Structure of Galectin 8, N-Terminal Domain


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 3 of Alpha and Beta Lactose Isomer Structure of Galectin 8, N-Terminal Domain within 5.0Å range: probe atom residue distance (Å) B Occ B:Cl201 b:28.6 occ:1.00 O3 G:GAL2 3.0 25.6 0.5 O3 H:GAL2 3.0 25.7 0.5 NH2 B:ARG59 3.2 27.5 1.0 NE2 B:GLN47 3.3 21.7 1.0 NH1 B:ARG59 3.4 28.9 1.0 CZ B:ARG59 3.8 24.5 1.0 O B:HOH390 3.8 39.4 1.0 CZ2 B:TRP86 3.8 23.7 1.0 C3 G:GAL2 3.8 25.4 0.5 C3 H:GAL2 3.9 25.5 0.5 OE1 B:GLN47 4.0 23.6 1.0 CD B:GLN47 4.1 22.9 1.0 CE1 B:HIS65 4.1 20.4 1.0 NH2 B:ARG45 4.1 22.8 1.0 C4 G:GAL2 4.2 22.1 0.5 C4 H:GAL2 4.2 22.0 0.5 O B:HOH361 4.4 37.6 1.0 CH2 B:TRP86 4.6 21.3 1.0 O4 G:GAL2 4.6 23.9 0.5 O4 H:GAL2 4.6 23.9 0.5 CE2 B:TRP86 4.7 22.3 1.0 NE2 B:HIS65 4.8 20.3 1.0 ND1 B:HIS65 4.8 17.7 1.0 NE1 B:TRP86 4.9 25.3 1.0

M.Hassan, M.Hakansson. Alpha and Beta Lactose Isomer Structure of Galectin 8, N-Terminal Domain To Be Published.