Chlorine in PDB 3f7q: First Pair of Fibronectin Type III Domains and Part of the Connecting Segment of the Integrin BETA4

The structure of First Pair of Fibronectin Type III Domains and Part of the Connecting Segment of the Integrin BETA4, PDB code: 3f7q was solved by J.M.De Pereda, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	22.27 / 1.75
Space group	P 1
Cell size a, b, c (Å), α, β, γ (°)	43.110, 49.470, 74.360, 107.22, 96.06, 106.60
R / Rfree (%)	15.5 / 18.2

The binding sites of Chlorine atom in the First Pair of Fibronectin Type III Domains and Part of the Connecting Segment of the Integrin BETA4 (pdb code 3f7q). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 2 binding sites of Chlorine where determined in the First Pair of Fibronectin Type III Domains and Part of the Connecting Segment of the Integrin BETA4, PDB code: 3f7q:
Jump to Chlorine binding site number: 1; 2;

Chlorine binding site 1 out of 2 in the First Pair of Fibronectin Type III Domains and Part of the Connecting Segment of the Integrin BETA4


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of First Pair of Fibronectin Type III Domains and Part of the Connecting Segment of the Integrin BETA4 within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl601 b:24.9 occ:1.00 H A:ARG1141 2.4 15.5 1.0 HZ3 B:LYS1142 2.5 51.1 1.0 HA3 A:GLY1139 2.7 20.4 1.0 H A:SER1140 2.8 18.8 1.0 HE2 A:LYS1142 2.8 39.2 1.0 O A:HOH238 3.1 35.5 1.0 HB2 A:ARG1141 3.2 15.6 1.0 N A:ARG1141 3.2 18.2 1.0 NZ B:LYS1142 3.2 52.1 1.0 HZ1 B:LYS1142 3.3 51.1 1.0 HG3 A:LYS1142 3.3 26.4 1.0 N A:SER1140 3.3 22.1 1.0 HZ2 B:LYS1142 3.5 51.1 1.0 O B:HOH237 3.5 32.3 1.0 HE3 A:LYS1142 3.6 39.2 1.0 CA A:GLY1139 3.6 23.7 1.0 CE A:LYS1142 3.6 43.2 1.0 HB2 A:LYS1142 3.7 22.0 1.0 H A:LYS1142 3.8 12.1 1.0 C A:GLY1139 3.8 26.0 1.0 O A:HOH141 3.9 35.7 1.0 CA A:ARG1141 3.9 19.7 1.0 CB A:ARG1141 3.9 18.3 1.0 N A:LYS1142 4.0 15.1 1.0 OG A:SER1140 4.0 22.7 1.0 O A:HOH304 4.1 42.0 1.0 HA2 A:GLY1139 4.1 20.4 1.0 CG A:LYS1142 4.1 29.8 1.0 C A:ARG1141 4.1 17.2 1.0 C A:SER1140 4.2 21.1 1.0 CA A:SER1140 4.3 23.0 1.0 CL B:CL602 4.3 26.4 1.0 CB A:LYS1142 4.3 26.7 1.0 HG3 A:ARG1141 4.3 16.5 1.0 O A:ALA1138 4.4 28.3 1.0 HZ1 A:LYS1142 4.5 46.7 1.0 CD A:LYS1142 4.5 36.0 1.0 HD3 B:LYS1142 4.5 35.9 1.0 CE B:LYS1142 4.5 47.6 1.0 N A:GLY1139 4.6 26.4 1.0 NZ A:LYS1142 4.6 49.9 1.0 HG A:SER1140 4.6 19.5 1.0 HE2 B:LYS1142 4.6 43.6 1.0 HB3 A:ARG1141 4.6 15.6 1.0 CG A:ARG1141 4.7 20.0 1.0 HD2 A:ARG1141 4.7 16.1 1.0 CB A:SER1140 4.8 28.3 1.0 CA A:LYS1142 4.8 15.5 1.0 C A:ALA1138 4.8 28.6 1.0 O A:GLY1139 4.8 21.2 1.0 HA A:ARG1141 4.8 16.6 1.0 HG2 A:LYS1142 4.9 26.4 1.0 HZ3 A:LYS1142 4.9 46.7 1.0 O A:ARG1141 5.0 18.2 1.0

Chlorine binding site 2 out of 2 in the First Pair of Fibronectin Type III Domains and Part of the Connecting Segment of the Integrin BETA4


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of First Pair of Fibronectin Type III Domains and Part of the Connecting Segment of the Integrin BETA4 within 5.0Å range: probe atom residue distance (Å) B Occ B:Cl602 b:26.4 occ:1.00 H B:ARG1141 2.4 13.7 1.0 HA3 B:GLY1139 2.7 19.9 1.0 HE2 B:LYS1142 2.9 43.6 1.0 H B:SER1140 2.9 15.2 1.0 HZ1 A:LYS1142 3.0 46.7 1.0 HZ3 A:LYS1142 3.1 46.7 1.0 O B:HOH237 3.1 32.3 1.0 HB2 B:ARG1141 3.2 16.4 1.0 N B:ARG1141 3.3 17.1 1.0 N B:SER1140 3.4 18.0 1.0 HE2 A:LYS1142 3.4 39.2 1.0 HZ3 B:LYS1142 3.4 51.1 1.0 NZ A:LYS1142 3.4 49.9 1.0 O A:HOH238 3.5 35.5 1.0 CA B:GLY1139 3.6 24.4 1.0 HB2 B:LYS1142 3.6 20.6 1.0 HZ1 B:LYS1142 3.6 51.1 1.0 H B:LYS1142 3.7 15.3 1.0 CE B:LYS1142 3.7 47.6 1.0 NZ B:LYS1142 3.7 52.1 1.0 C B:GLY1139 3.8 22.8 1.0 HG3 B:LYS1142 3.8 30.9 1.0 O B:HOH163 3.8 34.8 1.0 CE A:LYS1142 3.9 43.2 1.0 CA B:ARG1141 3.9 19.1 1.0 N B:LYS1142 3.9 18.2 1.0 CB B:ARG1141 4.0 20.9 1.0 OG B:SER1140 4.0 19.6 1.0 O B:HOH274 4.1 39.6 1.0 HA2 B:GLY1139 4.2 19.9 1.0 C B:ARG1141 4.2 21.9 1.0 C B:SER1140 4.2 17.4 1.0 CA B:SER1140 4.3 17.6 1.0 HZ2 A:LYS1142 4.3 46.7 1.0 CB B:LYS1142 4.3 23.4 1.0 CL A:CL601 4.3 24.9 1.0 HE3 B:LYS1142 4.3 43.6 1.0 CG B:LYS1142 4.4 33.8 1.0 O B:ALA1138 4.4 31.0 1.0 HG3 B:ARG1141 4.4 16.6 1.0 N B:GLY1139 4.5 21.5 1.0 HE3 A:LYS1142 4.5 39.2 1.0 CD B:LYS1142 4.6 39.5 1.0 HG B:SER1140 4.6 16.2 1.0 HB3 B:ARG1141 4.7 16.4 1.0 HZ2 B:LYS1142 4.7 51.1 1.0 HD2 B:ARG1141 4.7 17.8 1.0 CG B:ARG1141 4.7 18.7 1.0 O B:GLY1139 4.7 22.4 1.0 C B:ALA1138 4.8 29.3 1.0 CA B:LYS1142 4.8 16.1 1.0 HD3 B:LYS1142 4.8 35.9 1.0 CB B:SER1140 4.8 22.8 1.0 HD3 A:LYS1142 4.8 31.4 1.0 HA B:ARG1141 4.9 15.0 1.0 CD A:LYS1142 5.0 36.0 1.0

J.M.De Pereda, M.P.Lillo, A.Sonnenberg. Structural Basis of the Interaction Between Integrin ALPHA6BETA4 and Plectin at the Hemidesmosomes Embo J. V. 28 1180 2009.
ISSN: ISSN 0261-4189
PubMed: 19242489
DOI: 10.1038/EMBOJ.2009.48