Zinc in PDB 2wxd: A Micromolar O-Sulfated Thiohydroximate Inhibitor Bound to Plant Myrosinase

All present enzymatic activity of A Micromolar O-Sulfated Thiohydroximate Inhibitor Bound to Plant Myrosinase:
3.2.3.1;

The structure of A Micromolar O-Sulfated Thiohydroximate Inhibitor Bound to Plant Myrosinase, PDB code: 2wxd was solved by A.Besle, W.P.Burmeister, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	68.78 / 1.60
Space group	C 2 2 21
Cell size a, b, c (Å), α, β, γ (°)	136.245, 137.567, 80.723, 90.00, 90.00, 90.00
R / Rfree (%)	14.3 / 16.4

The binding sites of Zinc atom in the A Micromolar O-Sulfated Thiohydroximate Inhibitor Bound to Plant Myrosinase (pdb code 2wxd). This binding sites where shown within 5.0 Angstroms radius around Zinc atom.
In total only one binding site of Zinc was determined in the A Micromolar O-Sulfated Thiohydroximate Inhibitor Bound to Plant Myrosinase, PDB code: 2wxd:

Zinc binding site 1 out of 1 in the A Micromolar O-Sulfated Thiohydroximate Inhibitor Bound to Plant Myrosinase


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 1 of A Micromolar O-Sulfated Thiohydroximate Inhibitor Bound to Plant Myrosinase within 5.0Å range: probe atom residue distance (Å) B Occ M:Zn1502 b:8.3 occ:0.50 NE2 M:HIS56 1.9 7.4 1.0 OD2 M:ASP70 2.0 9.8 1.0 CG M:ASP70 2.8 8.5 1.0 CE1 M:HIS56 3.0 9.4 1.0 CD2 M:HIS56 3.0 9.2 1.0 OD1 M:ASP70 3.0 9.9 1.0 O M:HOH3128 3.7 18.0 1.0 ND1 M:HIS56 4.1 8.9 1.0 CG M:HIS56 4.1 9.9 1.0 CB M:ASP70 4.2 9.0 1.0 ND2 M:ASN68 4.4 11.3 1.0 OD1 M:ASN68 4.8 10.4 1.0 CG M:ASN68 4.9 12.3 1.0

A.Besle, X.Brazzolotto, A.Tatibouet, D.Cerniauskaite, E.Gallienne, P.Rollin, W.P.Burmeister. A Micromolar O-Sulfated Thiohydroximate Inhibitor Bound to Plant Myrosinase Acta Crystallogr.,Sect.F V. 66 152 2010.
ISSN: ESSN 1744-3091
PubMed: 20124710
DOI: 10.1107/S1744309109052865