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Zinc in PDB 3lsb: Crystal Structure of the Mutant E241Q of Atrazine Chlorohydrolase Trzn From Arthrobacter Aurescens TC1 Complexed with Zinc and Ametrin

Protein crystallography data

The structure of Crystal Structure of the Mutant E241Q of Atrazine Chlorohydrolase Trzn From Arthrobacter Aurescens TC1 Complexed with Zinc and Ametrin, PDB code: 3lsb was solved by A.A.Fedorov, E.V.Fedorov, J.Seffernick, L.P.Wackett, S.C.Almo, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 39.05 / 1.93
Space group P 1 21 1
Cell size a, b, c (Å), α, β, γ (°) 57.398, 100.845, 80.635, 90.00, 104.42, 90.00
R / Rfree (%) 19.1 / 22.8

Zinc Binding Sites:

The binding sites of Zinc atom in the Crystal Structure of the Mutant E241Q of Atrazine Chlorohydrolase Trzn From Arthrobacter Aurescens TC1 Complexed with Zinc and Ametrin (pdb code 3lsb). This binding sites where shown within 5.0 Angstroms radius around Zinc atom.
In total 2 binding sites of Zinc where determined in the Crystal Structure of the Mutant E241Q of Atrazine Chlorohydrolase Trzn From Arthrobacter Aurescens TC1 Complexed with Zinc and Ametrin, PDB code: 3lsb:
Jump to Zinc binding site number: 1; 2;

Zinc binding site 1 out of 2 in 3lsb

Go back to Zinc Binding Sites List in 3lsb
Zinc binding site 1 out of 2 in the Crystal Structure of the Mutant E241Q of Atrazine Chlorohydrolase Trzn From Arthrobacter Aurescens TC1 Complexed with Zinc and Ametrin


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 1 of Crystal Structure of the Mutant E241Q of Atrazine Chlorohydrolase Trzn From Arthrobacter Aurescens TC1 Complexed with Zinc and Ametrin within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Zn458

b:34.1
occ:1.00
NE2 A:HIS238 2.1 34.3 1.0
NE2 A:HIS65 2.1 31.7 1.0
NE2 A:HIS63 2.1 31.7 1.0
O A:HOH567 2.2 31.9 1.0
CE1 A:HIS65 2.8 33.2 1.0
CE1 A:HIS238 3.0 34.2 1.0
CE1 A:HIS63 3.1 32.8 1.0
CD2 A:HIS238 3.1 33.2 1.0
CD2 A:HIS63 3.2 29.2 1.0
CD2 A:HIS65 3.2 33.0 1.0
OG1 A:THR325 3.5 36.2 1.0
C4 A:RYN457 3.8 42.3 1.0
N3 A:RYN457 3.9 43.0 1.0
OE1 A:GLN129 4.0 33.8 1.0
N5 A:RYN457 4.0 41.6 1.0
ND1 A:HIS65 4.0 32.2 1.0
C2 A:RYN457 4.1 42.6 1.0
ND1 A:HIS238 4.1 34.1 1.0
C6 A:RYN457 4.2 42.7 1.0
ND1 A:HIS63 4.2 31.6 1.0
N1 A:RYN457 4.2 41.9 1.0
CG A:HIS238 4.2 33.6 1.0
CG A:HIS65 4.2 31.5 1.0
NE2 A:HIS274 4.3 30.7 1.0
CG A:HIS63 4.3 31.9 1.0
N7 A:RYN457 4.3 41.8 1.0
CB A:THR325 4.7 30.5 1.0
O A:HOH464 4.9 32.0 1.0
CD2 A:HIS274 4.9 29.0 1.0
N11 A:RYN457 4.9 44.5 1.0

Zinc binding site 2 out of 2 in 3lsb

Go back to Zinc Binding Sites List in 3lsb
Zinc binding site 2 out of 2 in the Crystal Structure of the Mutant E241Q of Atrazine Chlorohydrolase Trzn From Arthrobacter Aurescens TC1 Complexed with Zinc and Ametrin


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 2 of Crystal Structure of the Mutant E241Q of Atrazine Chlorohydrolase Trzn From Arthrobacter Aurescens TC1 Complexed with Zinc and Ametrin within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Zn457

b:37.7
occ:1.00
NE2 B:HIS65 2.1 36.3 1.0
NE2 B:HIS63 2.1 31.4 1.0
NE2 B:HIS238 2.2 33.6 1.0
O B:HOH537 2.2 31.7 1.0
CE1 B:HIS65 3.0 34.9 1.0
CE1 B:HIS63 3.0 35.1 1.0
CD2 B:HIS238 3.1 33.0 1.0
CD2 B:HIS65 3.1 31.0 1.0
CD2 B:HIS63 3.1 34.2 1.0
CE1 B:HIS238 3.2 40.8 1.0
OG1 B:THR325 3.5 42.1 1.0
ND1 B:HIS65 4.1 34.7 1.0
OE1 B:GLN129 4.1 37.0 1.0
ND1 B:HIS63 4.2 34.4 1.0
CG B:HIS65 4.2 35.7 1.0
NE2 B:HIS274 4.2 34.7 1.0
CG B:HIS238 4.2 38.8 1.0
CG B:HIS63 4.3 33.0 1.0
ND1 B:HIS238 4.3 40.1 1.0
O B:HOH479 4.7 36.9 1.0
CB B:THR325 4.9 37.0 1.0
CD2 B:HIS274 4.9 39.3 1.0
CD1 B:LEU131 5.0 46.5 1.0

Reference:

A.A.Fedorov, E.V.Fedorov, J.Seffernick, L.P.Wackett, S.C.Almo. Crystal Structure of the Mutant E241Q of Atrazine Chlorohydrolase Trzn From Arthrobacter Aurescens TC1 Complexed with Zinc and Ametryn To Be Published.
Page generated: Wed Dec 16 04:32:56 2020

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