Chlorine in PDB 3tgw: Crystal Structure of Subunit B Mutant H156A of the A1AO Atp Synthase

Enzymatic activity of Crystal Structure of Subunit B Mutant H156A of the A1AO Atp Synthase

All present enzymatic activity of Crystal Structure of Subunit B Mutant H156A of the A1AO Atp Synthase:
3.6.3.14;

Protein crystallography data

The structure of Crystal Structure of Subunit B Mutant H156A of the A1AO Atp Synthase, PDB code: 3tgw was solved by V.S.Tadwal, M.S.S.Manimekalai, J.Jeyakanthan, G.Gruber, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 20.10 / 1.75
Space group P 21 21 21
Cell size a, b, c (Å), α, β, γ (°) 73.933, 95.802, 130.268, 90.00, 90.00, 90.00
R / Rfree (%) 14.7 / 19.7

Other elements in 3tgw:

The structure of Crystal Structure of Subunit B Mutant H156A of the A1AO Atp Synthase also contains other interesting chemical elements:

Fluorine (F) 1 atom

Chlorine Binding Sites:

The binding sites of Chlorine atom in the Crystal Structure of Subunit B Mutant H156A of the A1AO Atp Synthase (pdb code 3tgw). 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 Subunit B Mutant H156A of the A1AO Atp Synthase, PDB code: 3tgw:
Jump to Chlorine binding site number: 1; 2;

Chlorine binding site 1 out of 2 in 3tgw

Go back to Chlorine Binding Sites List in 3tgw
Chlorine binding site 1 out of 2 in the Crystal Structure of Subunit B Mutant H156A of the A1AO Atp Synthase


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 Subunit B Mutant H156A of the A1AO Atp Synthase within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl467

b:21.5
occ:1.00
O A:HOH486 3.0 38.7 1.0
O A:HOH601 3.1 26.9 1.0
NH1 B:ARG334 3.1 16.9 1.0
N A:ASP316 3.4 19.7 1.0
CA B:GLU331 3.7 16.3 1.0
CD2 A:TYR277 3.7 24.4 1.0
CB A:ASP316 3.8 18.9 1.0
CB B:GLU331 3.8 17.3 1.0
CA A:PRO315 4.0 19.8 1.0
CD B:ARG334 4.0 19.3 1.0
CG B:GLU331 4.0 24.1 1.0
CE2 A:TYR277 4.1 28.7 1.0
C A:PRO315 4.2 18.4 1.0
N B:GLU331 4.2 15.6 1.0
O A:HOH710 4.3 31.1 1.0
CA A:ASP316 4.3 17.9 1.0
CZ B:ARG334 4.3 19.6 1.0
CB A:PRO315 4.5 20.3 1.0
NE B:ARG334 4.7 19.6 1.0
C B:ARG330 4.9 18.1 1.0
CD B:GLU331 4.9 33.4 1.0
C B:GLU331 5.0 17.8 1.0
CG A:TYR277 5.0 24.6 1.0

Chlorine binding site 2 out of 2 in 3tgw

Go back to Chlorine Binding Sites List in 3tgw
Chlorine binding site 2 out of 2 in the Crystal Structure of Subunit B Mutant H156A of the A1AO Atp Synthase


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 Subunit B Mutant H156A of the A1AO Atp Synthase within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Cl464

b:22.6
occ:1.00
OH B:TYR277 3.0 23.9 1.0
O B:HOH845 3.2 26.7 1.0
N B:ASP316 3.2 20.0 1.0
O A:HOH742 3.2 47.0 1.0
CE B:MET276 3.7 20.3 1.0
CA B:PRO315 3.8 25.3 1.0
CE2 B:TYR277 3.8 16.8 1.0
CZ B:TYR277 3.9 21.5 1.0
CD A:ARG330 3.9 22.1 1.0
CD1 B:TYR272 3.9 23.9 1.0
CB B:ASP316 3.9 16.6 1.0
C B:PRO315 3.9 23.3 1.0
CA B:ASP316 4.1 18.0 1.0
CB B:TYR272 4.3 25.4 1.0
O B:ILE314 4.3 29.1 1.0
O B:HOH826 4.3 48.6 1.0
NE A:ARG330 4.4 27.1 1.0
CB A:ARG330 4.4 15.9 1.0
CG A:ARG330 4.5 17.8 1.0
NH1 A:ARG334 4.5 29.1 1.0
CG B:TYR272 4.5 25.5 1.0
CB B:PRO315 4.7 26.0 1.0
CE1 B:TYR272 4.8 25.3 1.0
N B:PRO315 4.9 27.6 1.0
O B:ASP316 4.9 16.1 1.0
C B:ASP316 5.0 16.0 1.0

Reference:

V.S.Tadwal, M.S.S.Manimekalai, G.Gruber. Structure of Subunit A Mutants H156A, N157A and N157T of the A1AO Atp Synthase To Be Published.
Page generated: Sat Dec 12 10:12:07 2020

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