Chlorine in PDB 6mn0: Crystal Structure of Meta-AAC0038, An Environmental Aminoglycoside Resistance Enzyme, H168A Mutant in Complex with Acetyl-Coa

Enzymatic activity of Crystal Structure of Meta-AAC0038, An Environmental Aminoglycoside Resistance Enzyme, H168A Mutant in Complex with Acetyl-Coa

All present enzymatic activity of Crystal Structure of Meta-AAC0038, An Environmental Aminoglycoside Resistance Enzyme, H168A Mutant in Complex with Acetyl-Coa:
2.3.1.81;

Protein crystallography data

The structure of Crystal Structure of Meta-AAC0038, An Environmental Aminoglycoside Resistance Enzyme, H168A Mutant in Complex with Acetyl-Coa, PDB code: 6mn0 was solved by P.J.Stogios, T.Skarina, X.Zu, V.Yim, A.Savchenko, A.Joachimiak, K.J.Satchell, Center For Structural Genomics Of Infectious Diseases(Csgid), with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 24.93 / 2.40
Space group C 1 2 1
Cell size a, b, c (Å), α, β, γ (°) 108.078, 159.620, 143.321, 90.00, 94.56, 90.00
R / Rfree (%) 17.8 / 20.8

Chlorine Binding Sites:

The binding sites of Chlorine atom in the Crystal Structure of Meta-AAC0038, An Environmental Aminoglycoside Resistance Enzyme, H168A Mutant in Complex with Acetyl-Coa (pdb code 6mn0). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 3 binding sites of Chlorine where determined in the Crystal Structure of Meta-AAC0038, An Environmental Aminoglycoside Resistance Enzyme, H168A Mutant in Complex with Acetyl-Coa, PDB code: 6mn0:
Jump to Chlorine binding site number: 1; 2; 3;

Chlorine binding site 1 out of 3 in 6mn0

Go back to Chlorine Binding Sites List in 6mn0
Chlorine binding site 1 out of 3 in the Crystal Structure of Meta-AAC0038, An Environmental Aminoglycoside Resistance Enzyme, H168A Mutant in Complex with Acetyl-Coa


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 Meta-AAC0038, An Environmental Aminoglycoside Resistance Enzyme, H168A Mutant in Complex with Acetyl-Coa within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl302

b:53.6
occ:1.00
NE A:ARG257 3.5 57.9 1.0
NH2 A:ARG260 3.8 33.0 1.0
O A:HOH530 3.9 30.8 1.0
NE A:ARG260 4.1 34.1 1.0
CD A:ARG257 4.1 53.3 1.0
CG A:ARG257 4.2 47.1 1.0
CZ A:ARG260 4.4 35.9 1.0
CZ A:ARG257 4.5 56.2 1.0
NH2 A:ARG257 4.6 55.0 1.0
CB A:ARG257 4.6 37.7 1.0
CA A:ARG257 5.0 31.4 1.0

Chlorine binding site 2 out of 3 in 6mn0

Go back to Chlorine Binding Sites List in 6mn0
Chlorine binding site 2 out of 3 in the Crystal Structure of Meta-AAC0038, An Environmental Aminoglycoside Resistance Enzyme, H168A Mutant in Complex with Acetyl-Coa


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 Meta-AAC0038, An Environmental Aminoglycoside Resistance Enzyme, H168A Mutant in Complex with Acetyl-Coa within 5.0Å range:
probe atom residue distance (Å) B Occ
C:Cl302

b:46.3
occ:1.00
ND1 F:HIS80 3.1 41.7 1.0
O F:HOH614 3.1 59.5 1.0
OG C:SER9 3.2 42.3 1.0
N C:SER9 3.4 25.1 1.0
CB C:SER9 3.4 34.0 1.0
CE1 F:HIS80 3.8 41.5 1.0
CB C:THR7 3.9 25.2 1.0
OG1 C:THR7 4.0 25.4 1.0
CA C:SER9 4.0 28.7 1.0
N C:ARG8 4.1 23.3 1.0
CG F:HIS80 4.1 35.4 1.0
CB C:ARG8 4.2 23.2 1.0
C C:ARG8 4.3 23.9 1.0
O C:HOH550 4.3 53.4 1.0
O C:HOH436 4.4 23.9 1.0
CB F:HIS80 4.4 32.0 1.0
CA C:ARG8 4.4 22.2 1.0
CA F:HIS80 4.4 34.2 1.0
O C:HOH432 4.5 23.6 1.0
C C:THR7 4.8 26.3 1.0
CG2 C:THR7 4.8 27.5 1.0
CA C:THR7 4.9 27.7 1.0
O F:GLU79 4.9 39.6 1.0

Chlorine binding site 3 out of 3 in 6mn0

Go back to Chlorine Binding Sites List in 6mn0
Chlorine binding site 3 out of 3 in the Crystal Structure of Meta-AAC0038, An Environmental Aminoglycoside Resistance Enzyme, H168A Mutant in Complex with Acetyl-Coa


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 3 of Crystal Structure of Meta-AAC0038, An Environmental Aminoglycoside Resistance Enzyme, H168A Mutant in Complex with Acetyl-Coa within 5.0Å range:
probe atom residue distance (Å) B Occ
F:Cl302

b:66.5
occ:1.00
O F:HOH435 3.3 46.1 1.0
NH2 F:ARG197 4.0 28.9 1.0
NE F:ARG197 4.2 36.6 1.0
O4 F:SO4303 4.4 47.8 0.7
O F:HOH664 4.6 45.6 1.0
CZ F:ARG197 4.6 34.8 1.0

Reference:

P.J.Stogios, P.J.Stogios, T.Skarina, X.Zu, V.Yim, A.Savchenko, A.Joachimiak, K.J.Satchell, Center For Structural Genomics Of Infectious Diseases(Csgid). N/A N/A.
Page generated: Sat Dec 12 13:21:44 2020

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