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Chlorine in PDB 4my3: Crystal Structure of GCN5-Related N-Acetyltransferase From Kribbella Flavida

Protein crystallography data

The structure of Crystal Structure of GCN5-Related N-Acetyltransferase From Kribbella Flavida, PDB code: 4my3 was solved by Y.Kim, J.Mack, M.Endres, A.Joachimiak, Midwest Center For Structuralgenomics (Mcsg), with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 41.97 / 2.57
Space group P 21 21 21
Cell size a, b, c (Å), α, β, γ (°) 89.246, 167.120, 183.169, 90.00, 90.00, 90.00
R / Rfree (%) 17.6 / 23.5

Chlorine Binding Sites:

The binding sites of Chlorine atom in the Crystal Structure of GCN5-Related N-Acetyltransferase From Kribbella Flavida (pdb code 4my3). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 2 binding sites of Chlorine where determined in the Crystal Structure of GCN5-Related N-Acetyltransferase From Kribbella Flavida, PDB code: 4my3:
Jump to Chlorine binding site number: 1; 2;

Chlorine binding site 1 out of 2 in 4my3

Go back to Chlorine Binding Sites List in 4my3
Chlorine binding site 1 out of 2 in the Crystal Structure of GCN5-Related N-Acetyltransferase From Kribbella Flavida


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 GCN5-Related N-Acetyltransferase From Kribbella Flavida within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl401

b:52.5
occ:1.00
O A:HOH546 3.1 42.0 1.0
NE A:ARG22 3.2 53.6 1.0
NE1 A:TRP37 3.6 46.7 1.0
CD A:ARG22 3.6 49.1 1.0
NH1 A:ARG64 3.7 36.7 0.6
CA A:GLY84 3.8 34.3 1.0
CG A:ARG22 4.2 44.2 1.0
CZ2 A:TRP37 4.3 43.0 1.0
CE2 A:TRP37 4.3 47.0 1.0
CZ A:ARG22 4.4 55.6 1.0
O A:GLY84 4.4 40.6 1.0
C A:GLY84 4.5 36.7 1.0
NH2 A:ARG22 4.6 57.4 1.0
CD1 A:TRP37 4.7 49.7 1.0
CG1 A:VAL86 4.9 33.6 1.0
NH2 A:ARG64 4.9 42.6 0.4
CZ A:ARG64 4.9 39.0 0.6
N A:GLY84 5.0 30.2 1.0

Chlorine binding site 2 out of 2 in 4my3

Go back to Chlorine Binding Sites List in 4my3
Chlorine binding site 2 out of 2 in the Crystal Structure of GCN5-Related N-Acetyltransferase From Kribbella Flavida


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 GCN5-Related N-Acetyltransferase From Kribbella Flavida within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Cl401

b:34.0
occ:1.00
O D:HOH567 2.7 28.8 1.0
O D:HOH566 2.7 6.0 1.0
NE B:ARG20 3.6 39.6 1.0
CD B:ARG24 3.6 29.2 1.0
CB B:ALA88 3.7 20.2 1.0
NE D:ARG159 3.8 28.9 1.0
NE B:ARG24 3.9 31.7 1.0
CD D:ARG159 4.0 27.2 1.0
CD B:ARG20 4.2 39.4 1.0
CA B:VAL21 4.2 25.5 1.0
CG2 B:VAL21 4.2 23.1 1.0
CZ B:ARG24 4.4 33.1 1.0
CG B:ARG20 4.4 37.0 1.0
CZ B:ARG20 4.5 43.5 1.0
N B:VAL21 4.6 26.9 1.0
CA B:ALA88 4.6 19.4 1.0
NH2 B:ARG20 4.6 43.2 1.0
NH2 B:ARG24 4.6 33.8 1.0
O B:ARG20 4.7 28.6 1.0
OE2 B:GLU90 4.7 25.0 1.0
CB B:VAL21 4.7 34.5 1.0
C B:ARG20 4.7 29.8 1.0
CZ D:ARG159 4.8 27.3 1.0
CD B:PRO89 4.9 26.9 1.0
OH D:TYR204 4.9 28.0 1.0
CG1 B:VAL21 5.0 20.8 1.0

Reference:

Y.Kim, J.Mack, M.Endres, A.Joachimiak. Crystal Structure of GCN5-Related N-Acetyltransferase From Kribbella Flavida To Be Published.
Page generated: Sat Dec 12 10:57:21 2020

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