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Chlorine in PDB 5krr: 1-Deoxy-D-Xylulose 5-Phosphate Reductoisomerase From Vibrio Vulnificus in Complex with Mn(2+)

Enzymatic activity of 1-Deoxy-D-Xylulose 5-Phosphate Reductoisomerase From Vibrio Vulnificus in Complex with Mn(2+)

All present enzymatic activity of 1-Deoxy-D-Xylulose 5-Phosphate Reductoisomerase From Vibrio Vulnificus in Complex with Mn(2+):
1.1.1.267;

Protein crystallography data

The structure of 1-Deoxy-D-Xylulose 5-Phosphate Reductoisomerase From Vibrio Vulnificus in Complex with Mn(2+), PDB code: 5krr was solved by N.Ussin, R.W.Abdulsalam, L.R.Offermann, M.Perdue, M.Chruszcz, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 50.00 / 2.50
Space group C 2 2 21
Cell size a, b, c (Å), α, β, γ (°) 64.840, 149.084, 242.512, 90.00, 90.00, 90.00
R / Rfree (%) 19.2 / 23

Other elements in 5krr:

The structure of 1-Deoxy-D-Xylulose 5-Phosphate Reductoisomerase From Vibrio Vulnificus in Complex with Mn(2+) also contains other interesting chemical elements:

Manganese (Mn) 2 atoms

Chlorine Binding Sites:

The binding sites of Chlorine atom in the 1-Deoxy-D-Xylulose 5-Phosphate Reductoisomerase From Vibrio Vulnificus in Complex with Mn(2+) (pdb code 5krr). 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-Deoxy-D-Xylulose 5-Phosphate Reductoisomerase From Vibrio Vulnificus in Complex with Mn(2+), PDB code: 5krr:

Chlorine binding site 1 out of 1 in 5krr

Go back to Chlorine Binding Sites List in 5krr
Chlorine binding site 1 out of 1 in the 1-Deoxy-D-Xylulose 5-Phosphate Reductoisomerase From Vibrio Vulnificus in Complex with Mn(2+)


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of 1-Deoxy-D-Xylulose 5-Phosphate Reductoisomerase From Vibrio Vulnificus in Complex with Mn(2+) within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl501

b:57.6
occ:1.00
N A:ASP172 3.5 43.4 1.0
CB A:CYS171 4.0 44.4 1.0
CG A:GLN176 4.0 38.7 1.0
CA A:VAL164 4.0 34.8 1.0
CA A:CYS171 4.0 45.5 1.0
O A:THR163 4.1 40.5 1.0
N A:VAL164 4.2 36.4 1.0
CG2 A:VAL164 4.2 34.2 1.0
C A:THR163 4.2 38.9 1.0
O A:ASP172 4.3 39.3 1.0
CB A:ASN167 4.3 46.4 1.0
C A:CYS171 4.3 44.7 1.0
CA A:ASP172 4.4 43.3 1.0
CD A:GLN176 4.5 40.8 1.0
C A:ASP172 4.5 39.8 1.0
CB A:ASP172 4.6 46.2 1.0
NE2 A:GLN176 4.6 43.4 1.0
CB A:VAL164 4.7 33.2 1.0
CG A:ASN167 4.8 51.1 1.0
CB A:THR163 5.0 42.5 1.0

Reference:

N.K.Ussin, A.M.Bagnell, L.R.Offermann, R.Abdulsalam, M.L.Perdue, P.Magee, M.Chruszcz. Structural Characterization of 1-Deoxy-D-Xylulose 5-Phosphate Reductoisomerase From Vibrio Vulnificus. Biochim Biophys Acta V.1866 1209 2018PROTEINS Proteom.
ISSN: ISSN 1878-1454
PubMed: 30278288
DOI: 10.1016/J.BBAPAP.2018.09.008
Page generated: Sat Jul 12 04:10:35 2025

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