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

Protein crystallography data

The structure of Crystal Structure of the Mutant E241Q of Atrazine Chlorohydrolase Trzn From Arthrobacter Aurescens TC1 Complexed with Zinc and Atraton, PDB code: 3lsc 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) 39.11 / 1.64
Space group P 1 21 1
Cell size a, b, c (Å), α, β, γ (°) 57.378, 101.621, 80.767, 90.00, 104.45, 90.00
R / Rfree (%) 18.9 / 21.4

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 Atraton (pdb code 3lsc). 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 Atraton, PDB code: 3lsc:
Jump to Zinc binding site number: 1; 2;

Zinc binding site 1 out of 2 in 3lsc

Go back to Zinc Binding Sites List in 3lsc
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 Atraton


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 Atraton within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Zn458

b:18.6
occ:1.00
O A:HOH501 2.0 18.9 1.0
NE2 A:HIS238 2.0 17.9 1.0
NE2 A:HIS65 2.1 17.3 1.0
NE2 A:HIS63 2.1 15.0 1.0
CE1 A:HIS65 2.9 19.5 1.0
CE1 A:HIS63 3.0 16.5 1.0
CD2 A:HIS238 3.0 18.0 1.0
CE1 A:HIS238 3.0 18.6 1.0
CD2 A:HIS63 3.1 16.4 1.0
CD2 A:HIS65 3.2 18.5 1.0
OG1 A:THR325 3.4 20.8 1.0
C4 A:AOO457 3.8 27.3 1.0
N3 A:AOO457 3.9 27.3 1.0
N5 A:AOO457 3.9 28.4 1.0
C2 A:AOO457 4.0 27.3 1.0
OE1 A:GLN129 4.1 21.8 1.0
ND1 A:HIS65 4.1 19.4 1.0
C6 A:AOO457 4.1 28.5 1.0
ND1 A:HIS238 4.1 17.5 1.0
N1 A:AOO457 4.1 28.4 1.0
ND1 A:HIS63 4.2 15.8 1.0
CG A:HIS238 4.2 18.1 1.0
NE2 A:HIS274 4.2 18.6 1.0
CG A:HIS65 4.2 17.1 1.0
CG A:HIS63 4.3 14.0 1.0
N7 A:AOO457 4.4 28.9 1.0
CB A:THR325 4.6 18.8 1.0
O21 A:AOO457 4.7 28.5 1.0
N11 A:AOO457 4.9 28.9 1.0
CD2 A:HIS274 4.9 16.3 1.0
O A:HOH488 4.9 19.0 1.0

Zinc binding site 2 out of 2 in 3lsc

Go back to Zinc Binding Sites List in 3lsc
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 Atraton


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 Atraton within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Zn457

b:20.4
occ:1.00
NE2 B:HIS65 2.0 18.7 1.0
O B:HOH502 2.0 19.9 1.0
NE2 B:HIS238 2.1 18.3 1.0
NE2 B:HIS63 2.1 17.6 1.0
CE1 B:HIS65 2.9 21.4 1.0
CD2 B:HIS238 3.0 20.6 1.0
CE1 B:HIS63 3.0 19.9 1.0
CE1 B:HIS238 3.1 22.3 1.0
CD2 B:HIS65 3.1 20.2 1.0
CD2 B:HIS63 3.1 17.6 1.0
OG1 B:THR325 3.4 29.4 1.0
ND1 B:HIS65 4.0 18.7 1.0
ND1 B:HIS238 4.2 21.6 1.0
CG B:HIS238 4.2 19.3 1.0
OE1 B:GLN129 4.2 22.3 1.0
ND1 B:HIS63 4.2 18.4 1.0
CG B:HIS65 4.2 21.4 1.0
NE2 B:HIS274 4.2 19.6 1.0
CG B:HIS63 4.3 17.5 1.0
CB B:THR325 4.7 23.3 1.0
CD2 B:HIS274 4.8 21.6 1.0
O B:HOH510 4.9 24.6 1.0
CD1 B:LEU131 4.9 30.5 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 Atraton To Be Published.
Page generated: Sat Oct 26 08:50:03 2024

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