Chlorine in PDB 7rh7: Mycobacterial CIII2CIV2 Supercomplex, Telacebec (Q203) Bound

Enzymatic activity of Mycobacterial CIII2CIV2 Supercomplex, Telacebec (Q203) Bound

All present enzymatic activity of Mycobacterial CIII2CIV2 Supercomplex, Telacebec (Q203) Bound:
1.15.1.1; 7.1.1.8; 7.1.1.9;

Other elements in 7rh7:

The structure of Mycobacterial CIII2CIV2 Supercomplex, Telacebec (Q203) Bound also contains other interesting chemical elements:

Iron (Fe) 16 atoms
Fluorine (F) 6 atoms
Copper (Cu) 6 atoms

Chlorine Binding Sites:

The binding sites of Chlorine atom in the Mycobacterial CIII2CIV2 Supercomplex, Telacebec (Q203) Bound (pdb code 7rh7). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 2 binding sites of Chlorine where determined in the Mycobacterial CIII2CIV2 Supercomplex, Telacebec (Q203) Bound, PDB code: 7rh7:
Jump to Chlorine binding site number: 1; 2;

Chlorine binding site 1 out of 2 in 7rh7

Go back to Chlorine Binding Sites List in 7rh7
Chlorine binding site 1 out of 2 in the Mycobacterial CIII2CIV2 Supercomplex, Telacebec (Q203) Bound


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Mycobacterial CIII2CIV2 Supercomplex, Telacebec (Q203) Bound within 5.0Å range:
probe atom residue distance (Å) B Occ
E:Cl607

b:36.1
occ:1.00
CL1 E:HUU607 0.0 36.1 1.0
C02 E:HUU607 1.8 36.1 1.0
O E:GLN300 2.7 35.5 1.0
C03 E:HUU607 2.8 36.1 1.0
C05 E:HUU607 2.8 36.1 1.0
H12 E:HUU607 2.9 36.1 1.0
H14 E:HUU607 2.9 36.1 1.0
HA3 E:GLY170 2.9 33.4 1.0
HG E:LEU166 3.1 35.3 1.0
O E:LEU166 3.2 35.3 1.0
HA E:SER167 3.2 32.9 1.0
HA E:PRO301 3.2 33.8 1.0
C E:GLN300 3.3 35.5 1.0
HE1 E:TYR159 3.4 32.1 1.0
H E:GLY170 3.6 33.4 1.0
CA E:GLY170 3.6 33.4 1.0
HA2 E:GLY170 3.7 33.4 1.0
N E:PRO301 3.8 33.8 1.0
C E:LEU166 3.8 35.3 1.0
HD12 E:LEU166 3.8 35.3 1.0
CA E:PRO301 3.9 33.8 1.0
HD11 E:LEU166 3.9 35.3 1.0
N E:GLY170 3.9 33.4 1.0
CG E:LEU166 4.0 35.3 1.0
C04 E:HUU607 4.1 36.1 1.0
N06 E:HUU607 4.1 36.1 1.0
HG23 E:THR169 4.1 34.3 1.0
CA E:SER167 4.1 32.9 1.0
HB3 E:PRO301 4.1 33.8 1.0
CD1 E:LEU166 4.1 35.3 1.0
CE1 E:TYR159 4.2 32.1 1.0
N E:GLN300 4.2 35.5 1.0
H E:GLN300 4.2 35.5 1.0
N E:SER167 4.2 32.9 1.0
HA E:SER299 4.3 36.3 1.0
CA E:GLN300 4.3 35.5 1.0
HD3 E:PRO301 4.5 33.8 1.0
C07 E:HUU607 4.6 36.1 1.0
CB E:PRO301 4.6 33.8 1.0
HA E:GLN300 4.6 35.5 1.0
C E:SER299 4.6 36.3 1.0
OH E:TYR159 4.7 32.1 1.0
HD21 E:LEU166 4.7 35.3 1.0
CD E:PRO301 4.7 33.8 1.0
HA E:LEU166 4.8 35.3 1.0
CA E:LEU166 4.8 35.3 1.0
HG22 E:THR169 4.8 34.3 1.0
C E:SER167 4.8 32.9 1.0
CZ E:TYR159 4.9 32.1 1.0
CG2 E:THR169 4.9 34.3 1.0
CB E:LEU166 4.9 35.3 1.0
CD2 E:LEU166 4.9 35.3 1.0
HG2 O:PRO268 4.9 35.2 1.0
O E:SER167 4.9 32.9 1.0
H13 E:HUU607 4.9 36.1 1.0
H E:SER167 4.9 32.9 1.0
HD1 E:TYR159 5.0 32.1 1.0
C E:GLY170 5.0 33.4 1.0
CA E:SER299 5.0 36.3 1.0

Chlorine binding site 2 out of 2 in 7rh7

Go back to Chlorine Binding Sites List in 7rh7
Chlorine binding site 2 out of 2 in the Mycobacterial CIII2CIV2 Supercomplex, Telacebec (Q203) Bound


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of Mycobacterial CIII2CIV2 Supercomplex, Telacebec (Q203) Bound within 5.0Å range:
probe atom residue distance (Å) B Occ
F:Cl608

b:37.3
occ:1.00
CL1 F:HUU608 0.0 37.3 1.0
C02 F:HUU608 1.8 37.3 1.0
C05 F:HUU608 2.8 37.3 1.0
C03 F:HUU608 2.8 37.3 1.0
HG F:LEU166 2.8 36.9 1.0
H14 F:HUU608 2.9 37.3 1.0
H12 F:HUU608 2.9 37.3 1.0
HA3 F:GLY170 3.0 34.6 1.0
O F:GLN300 3.0 36.9 1.0
O F:LEU166 3.0 36.9 1.0
HA F:SER167 3.3 35.7 1.0
HA F:PRO301 3.4 35.9 1.0
HE1 F:TYR159 3.6 36.8 1.0
H F:GLY170 3.6 34.6 1.0
C F:GLN300 3.6 36.9 1.0
CA F:GLY170 3.7 34.6 1.0
CG F:LEU166 3.7 36.9 1.0
C F:LEU166 3.7 36.9 1.0
HD11 F:LEU166 3.7 36.9 1.0
HA2 F:GLY170 3.8 34.6 1.0
HD12 F:LEU166 3.9 36.9 1.0
N F:GLY170 4.0 34.6 1.0
CD1 F:LEU166 4.0 36.9 1.0
N F:PRO301 4.0 35.9 1.0
HB3 F:PRO301 4.1 35.9 1.0
N06 F:HUU608 4.1 37.3 1.0
C04 F:HUU608 4.1 37.3 1.0
CA F:PRO301 4.1 35.9 1.0
HG23 F:THR169 4.1 35.2 1.0
CA F:SER167 4.2 35.7 1.0
HH F:TYR159 4.2 36.8 1.0
N F:SER167 4.2 35.7 1.0
CE1 F:TYR159 4.3 36.8 1.0
HD21 F:LEU166 4.3 36.9 1.0
HA F:SER299 4.3 37.1 1.0
HD3 F:PRO301 4.4 35.9 1.0
N F:GLN300 4.4 36.9 1.0
H F:GLN300 4.4 36.9 1.0
CD2 F:LEU166 4.5 36.9 1.0
C07 F:HUU608 4.6 37.3 1.0
HA F:LEU166 4.6 36.9 1.0
CA F:GLN300 4.6 36.9 1.0
CA F:LEU166 4.6 36.9 1.0
CB F:PRO301 4.6 35.9 1.0
CB F:LEU166 4.7 36.9 1.0
HD23 F:LEU166 4.7 36.9 1.0
HG22 F:THR169 4.7 35.2 1.0
CD F:PRO301 4.8 35.9 1.0
C F:SER299 4.8 37.1 1.0
OH F:TYR159 4.8 36.8 1.0
CG2 F:THR169 4.8 35.2 1.0
HA F:GLN300 4.9 36.9 1.0
C F:SER167 4.9 35.7 1.0
H F:SER167 4.9 35.7 1.0
H13 F:HUU608 4.9 37.3 1.0
O F:SER167 4.9 35.7 1.0
HD13 F:LEU166 5.0 36.9 1.0
HD1 F:TYR159 5.0 36.8 1.0
CZ F:TYR159 5.0 36.8 1.0
HG3 I:PRO268 5.0 37.0 1.0

Reference:

D.J.Yanofsky, J.M.Di Trani, S.Krol, R.Abdelaziz, S.A.Bueler, P.Imming, P.Brzezinski, J.L.Rubinstein. Structure of Mycobacterial CIII2CIV2 Respiratory Supercomplex Bound to the Tuberculosis Drug Candidate Telacebec (Q203) To Be Published.
Page generated: Sat Aug 21 13:24:33 2021

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