Chlorine in PDB 5u4q: 1.5 Angstrom Resolution Crystal Structure of Nad-Dependent Epimerase From Klebsiella Pneumoniae in Complex with Nad.

Enzymatic activity of 1.5 Angstrom Resolution Crystal Structure of Nad-Dependent Epimerase From Klebsiella Pneumoniae in Complex with Nad.

All present enzymatic activity of 1.5 Angstrom Resolution Crystal Structure of Nad-Dependent Epimerase From Klebsiella Pneumoniae in Complex with Nad.:
4.2.1.46;

Protein crystallography data

The structure of 1.5 Angstrom Resolution Crystal Structure of Nad-Dependent Epimerase From Klebsiella Pneumoniae in Complex with Nad., PDB code: 5u4q was solved by G.Minasov, L.Shuvalova, O.Kiryukhina, I.Dubrovska, B.Bishop, K.Kwon, W.F.Anderson, 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) 29.21 / 1.50
Space group P 1 21 1
Cell size a, b, c (Å), α, β, γ (°) 60.239, 55.845, 97.318, 90.00, 93.21, 90.00
R / Rfree (%) 18 / 21.1

Chlorine Binding Sites:

The binding sites of Chlorine atom in the 1.5 Angstrom Resolution Crystal Structure of Nad-Dependent Epimerase From Klebsiella Pneumoniae in Complex with Nad. (pdb code 5u4q). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total only one binding site of Chlorine was determined in the 1.5 Angstrom Resolution Crystal Structure of Nad-Dependent Epimerase From Klebsiella Pneumoniae in Complex with Nad., PDB code: 5u4q:

Chlorine binding site 1 out of 1 in 5u4q

Go back to Chlorine Binding Sites List in 5u4q
Chlorine binding site 1 out of 1 in the 1.5 Angstrom Resolution Crystal Structure of Nad-Dependent Epimerase From Klebsiella Pneumoniae in Complex with Nad.


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of 1.5 Angstrom Resolution Crystal Structure of Nad-Dependent Epimerase From Klebsiella Pneumoniae in Complex with Nad. within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl402

b:16.9
occ:1.00
 O A:HOH703 3.0 17.2 1.0
N A:GLY183 3.3 13.2 1.0
N A:PHE193 3.3 16.4 1.0
N A:LEU192 3.4 17.4 1.0
CB A:TYR182 3.6 14.1 1.0
CA A:TYR182 3.6 13.3 1.0
CB A:ALA191 3.8 18.8 1.0
CE1 A:PHE324 3.8 15.5 1.0
CB A:LEU192 3.8 18.2 1.0
CB A:PHE193 3.8 16.3 1.0
CD1 A:PHE324 3.9 15.1 1.0
O A:GLY183 3.9 13.1 1.0
CA A:LEU192 4.0 17.3 1.0
C A:TYR182 4.0 13.1 1.0
C A:LEU192 4.1 17.9 1.0
O A:MSE190 4.1 18.9 0.3
O A:MSE190 4.2 16.7 0.7
CA A:PHE193 4.2 16.3 1.0
C A:ALA191 4.3 18.4 1.0
CA A:GLY183 4.4 13.9 1.0
CA A:GLY186 4.5 13.4 1.0
CZ A:PHE324 4.5 15.7 1.0
CG A:LEU192 4.5 19.8 1.0
C A:GLY183 4.6 13.6 1.0
CA A:ALA191 4.6 18.4 1.0
O A:VAL181 4.7 13.2 1.0
CG A:TYR182 4.7 13.7 1.0
CG A:PHE324 4.7 14.4 1.0
CD2 A:TYR182 4.9 15.3 1.0
N A:TYR182 4.9 13.8 1.0
CG A:PHE193 5.0 16.9 1.0

Reference:

G.Minasov, L.Shuvalova, O.Kiryukhina, I.Dubrovska, B.Bishop, K.Kwon, W.F.Anderson, Center For Structural Genomics Of Infectious Diseases(Csgid). 1.5 Angstrom Resolution Crystal Structure of Nad-Dependent Epimerase From Klebsiella Pneumoniae in Complex with Nad. To Be Published.
Page generated: Sat Dec 12 12:30:24 2020

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