Copper in PDB 9fu0: CIII2/Civ Respiratory Chain Supercomplex From Mycobacterium Smegmatis

Enzymatic activity of CIII2/Civ Respiratory Chain Supercomplex From Mycobacterium Smegmatis

All present enzymatic activity of CIII2/Civ Respiratory Chain Supercomplex From Mycobacterium Smegmatis:
1.15.1.1; 7.1.1.8; 7.1.1.9;

Other elements in 9fu0:

The structure of CIII2/Civ Respiratory Chain Supercomplex From Mycobacterium Smegmatis also contains other interesting chemical elements:

Calcium (Ca) 1 atom
Iron (Fe) 12 atoms
Magnesium (Mg) 1 atom

Copper Binding Sites:

The binding sites of Copper atom in the CIII2/Civ Respiratory Chain Supercomplex From Mycobacterium Smegmatis (pdb code 9fu0). This binding sites where shown within 5.0 Angstroms radius around Copper atom.
In total 3 binding sites of Copper where determined in the CIII2/Civ Respiratory Chain Supercomplex From Mycobacterium Smegmatis, PDB code: 9fu0:
Jump to Copper binding site number: 1; 2; 3;

Copper binding site 1 out of 3 in 9fu0

Go back to Copper Binding Sites List in 9fu0
Copper binding site 1 out of 3 in the CIII2/Civ Respiratory Chain Supercomplex From Mycobacterium Smegmatis


Mono view


Stereo pair view

A full contact list of Copper with other atoms in the Cu binding site number 1 of CIII2/Civ Respiratory Chain Supercomplex From Mycobacterium Smegmatis within 5.0Å range:
probe atom residue distance (Å) B Occ
R:Cu604

b:62.5
occ:1.00
ND1 R:HIS264 2.1 44.2 1.0
NE2 R:HIS313 2.2 45.7 1.0
CE1 R:HIS314 2.3 44.7 1.0
CE1 R:HIS264 2.4 44.2 1.0
NE2 R:HIS314 2.5 44.7 1.0
CE1 R:HIS313 3.1 45.7 1.0
CD2 R:HIS313 3.2 45.7 1.0
ND1 R:HIS314 3.4 44.7 1.0
CG R:HIS264 3.4 44.2 1.0
NE2 R:HIS264 3.6 44.2 1.0
CD2 R:HIS314 3.7 44.7 1.0
C1A R:HEA602 3.7 41.6 1.0
NA R:HEA602 3.8 41.6 1.0
FE R:HEA602 3.8 41.6 1.0
C4A R:HEA602 3.9 41.6 1.0
C2A R:HEA602 4.1 41.6 1.0
CG R:HIS314 4.1 44.7 1.0
CD2 R:HIS264 4.1 44.2 1.0
C3A R:HEA602 4.1 41.6 1.0
ND R:HEA602 4.2 41.6 1.0
CB R:HIS264 4.2 44.2 1.0
ND1 R:HIS313 4.2 45.7 1.0
CHA R:HEA602 4.3 41.6 1.0
CG R:HIS313 4.3 45.7 1.0
C4D R:HEA602 4.4 41.6 1.0
NB R:HEA602 4.5 41.6 1.0
CHB R:HEA602 4.6 41.6 1.0
C1B R:HEA602 4.8 41.6 1.0
CAA R:HEA602 4.9 41.6 1.0
CA R:HIS264 4.9 44.2 1.0
CMA R:HEA602 5.0 41.6 1.0
NC R:HEA602 5.0 41.6 1.0
C1D R:HEA602 5.0 41.6 1.0

Copper binding site 2 out of 3 in 9fu0

Go back to Copper Binding Sites List in 9fu0
Copper binding site 2 out of 3 in the CIII2/Civ Respiratory Chain Supercomplex From Mycobacterium Smegmatis


Mono view


Stereo pair view

A full contact list of Copper with other atoms in the Cu binding site number 2 of CIII2/Civ Respiratory Chain Supercomplex From Mycobacterium Smegmatis within 5.0Å range:
probe atom residue distance (Å) B Occ
Q:Cu401

b:68.3
occ:1.00
ND1 Q:HIS232 2.0 49.4 1.0
SG Q:CYS277 2.1 50.6 1.0
CU Q:CU402 2.4 65.6 1.0
SG Q:CYS273 2.4 49.0 1.0
SD Q:MET284 2.6 49.0 1.0
CE1 Q:HIS232 2.8 49.4 1.0
CB Q:CYS277 3.0 50.6 1.0
CG Q:HIS232 3.0 49.4 1.0
CE Q:MET284 3.2 49.0 1.0
CB Q:HIS232 3.5 49.4 1.0
CB Q:CYS273 3.7 49.0 1.0
CA Q:HIS232 3.9 49.4 1.0
NE2 Q:HIS232 4.0 49.4 1.0
CD2 Q:HIS232 4.1 49.4 1.0
CG Q:MET284 4.1 49.0 1.0
O Q:GLU275 4.2 47.0 1.0
CA Q:CYS277 4.4 50.6 1.0
O Q:ILE231 4.5 48.4 1.0
ND1 Q:HIS281 4.7 47.0 1.0
N Q:CYS277 4.7 50.6 1.0
O Q:PHE136 4.8 54.7 1.0
CD1 Q:TRP138 4.9 53.9 1.0
CA Q:HIS281 4.9 47.0 1.0
N Q:GLY233 4.9 47.9 1.0
N Q:HIS232 4.9 49.4 1.0
C Q:HIS232 5.0 49.4 1.0

Copper binding site 3 out of 3 in 9fu0

Go back to Copper Binding Sites List in 9fu0
Copper binding site 3 out of 3 in the CIII2/Civ Respiratory Chain Supercomplex From Mycobacterium Smegmatis


Mono view


Stereo pair view

A full contact list of Copper with other atoms in the Cu binding site number 3 of CIII2/Civ Respiratory Chain Supercomplex From Mycobacterium Smegmatis within 5.0Å range:
probe atom residue distance (Å) B Occ
Q:Cu402

b:65.6
occ:1.00
SG Q:CYS273 1.9 49.0 1.0
SG Q:CYS277 2.2 50.6 1.0
ND1 Q:HIS281 2.3 47.0 1.0
CU Q:CU401 2.4 68.3 1.0
O Q:GLU275 2.7 47.0 1.0
CG Q:HIS281 3.1 47.0 1.0
CB Q:HIS281 3.3 47.0 1.0
CE1 Q:HIS281 3.3 47.0 1.0
CB Q:CYS277 3.4 50.6 1.0
CB Q:CYS273 3.4 49.0 1.0
CA Q:HIS281 3.5 47.0 1.0
N Q:CYS277 3.5 50.6 1.0
SD Q:MET284 3.8 49.0 1.0
C Q:GLU275 3.8 47.0 1.0
O Q:HIS281 3.9 47.0 1.0
CA Q:CYS277 4.1 50.6 1.0
C Q:HIS281 4.1 47.0 1.0
C Q:MET276 4.1 48.2 1.0
ND1 Q:HIS232 4.2 49.4 1.0
CA Q:MET276 4.2 48.2 1.0
CD2 Q:HIS281 4.3 47.0 1.0
NE2 Q:HIS281 4.3 47.0 1.0
N Q:MET276 4.5 48.2 1.0
C Q:CYS273 4.5 49.0 1.0
CA Q:CYS273 4.5 49.0 1.0
CG Q:MET284 4.7 49.0 1.0
O Q:CYS273 4.7 49.0 1.0
N Q:GLU275 4.8 47.0 1.0
N Q:HIS281 4.8 47.0 1.0
N Q:THR274 4.9 47.7 1.0
CA Q:GLU275 4.9 47.0 1.0
CA Q:HIS232 5.0 49.4 1.0
C Q:CYS277 5.0 50.6 1.0

Reference:

T.Kovalova, S.Krol, A.Gamiz-Hernandez, D.Sjostrand, V.Kaila, P.Brzezinski, M.Hogbom. Inhibition Mechanism of Potential Anti-Tuberculosis Compound Lansoprazole Sulfide To Be Published.
Page generated: Wed Nov 27 17:20:17 2024

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