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Chlorine in PDB 5hh4: Crystal Structure of Metallo-Beta-Lactamase Imp-1 in Complex with A Phosphonate-Based Inhibitor

Enzymatic activity of Crystal Structure of Metallo-Beta-Lactamase Imp-1 in Complex with A Phosphonate-Based Inhibitor

All present enzymatic activity of Crystal Structure of Metallo-Beta-Lactamase Imp-1 in Complex with A Phosphonate-Based Inhibitor:
3.5.2.6;

Protein crystallography data

The structure of Crystal Structure of Metallo-Beta-Lactamase Imp-1 in Complex with A Phosphonate-Based Inhibitor, PDB code: 5hh4 was solved by P.Hinchliffe, J.Spencer, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 58.16 / 2.00
Space group P 21 21 21
Cell size a, b, c (Å), α, β, γ (°) 48.943, 78.309, 260.545, 90.00, 90.00, 90.00
R / Rfree (%) 17.2 / 20.6

Other elements in 5hh4:

The structure of Crystal Structure of Metallo-Beta-Lactamase Imp-1 in Complex with A Phosphonate-Based Inhibitor also contains other interesting chemical elements:

Zinc (Zn) 8 atoms

Chlorine Binding Sites:

The binding sites of Chlorine atom in the Crystal Structure of Metallo-Beta-Lactamase Imp-1 in Complex with A Phosphonate-Based Inhibitor (pdb code 5hh4). 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 Crystal Structure of Metallo-Beta-Lactamase Imp-1 in Complex with A Phosphonate-Based Inhibitor, PDB code: 5hh4:

Chlorine binding site 1 out of 1 in 5hh4

Go back to Chlorine Binding Sites List in 5hh4
Chlorine binding site 1 out of 1 in the Crystal Structure of Metallo-Beta-Lactamase Imp-1 in Complex with A Phosphonate-Based Inhibitor


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 Metallo-Beta-Lactamase Imp-1 in Complex with A Phosphonate-Based Inhibitor within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Cl304

b:44.5
occ:1.00
CB B:LYS54 3.6 13.9 1.0
CG2 B:THR52 3.7 25.0 1.0
CB B:THR52 3.8 19.2 1.0
CD B:LYS54 3.8 33.0 1.0
OG1 B:THR52 3.8 18.3 1.0
CG B:LYS54 4.4 21.9 1.0
N B:LYS54 4.8 12.8 1.0
CA B:LYS54 4.9 13.4 1.0
CE B:LYS54 5.0 42.1 1.0

Reference:

P.Hinchliffe, C.A.Tanner, A.P.Krismanich, G.Labbe, V.J.Goodfellow, L.Marrone, A.Y.Desoky, K.Calvopina, E.E.Whittle, F.Zeng, M.B.Avison, N.C.Bols, S.Siemann, J.Spencer, G.I.Dmitrienko. Structural and Kinetic Studies of the Potent Inhibition of Metallo-Beta-Lactamases By 6-Phosphonomethylpyridine-2-Carboxylates. Biochemistry V. 57 1880 2018.
ISSN: ISSN 1520-4995
PubMed: 29485857
DOI: 10.1021/ACS.BIOCHEM.7B01299
Page generated: Fri Jul 26 08:50:31 2024

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