Atomistry » Mercury » PDB 3bl0-3k7k » 3ffp
Atomistry »
  Mercury »
    PDB 3bl0-3k7k »
      3ffp »

Mercury in PDB 3ffp: X Ray Structure of the Complex Between Carbonic Anhydrase II and Lc Inhibitors

Enzymatic activity of X Ray Structure of the Complex Between Carbonic Anhydrase II and Lc Inhibitors

All present enzymatic activity of X Ray Structure of the Complex Between Carbonic Anhydrase II and Lc Inhibitors:
4.2.1.1;

Protein crystallography data

The structure of X Ray Structure of the Complex Between Carbonic Anhydrase II and Lc Inhibitors, PDB code: 3ffp was solved by C.Temperini, L.Crocetti, A.Scozzafava, C.T.Supuran, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 11.83 / 1.81
Space group P 1 21 1
Cell size a, b, c (Å), α, β, γ (°) 42.180, 41.430, 72.240, 90.00, 104.47, 90.00
R / Rfree (%) 18.7 / 24

Other elements in 3ffp:

The structure of X Ray Structure of the Complex Between Carbonic Anhydrase II and Lc Inhibitors also contains other interesting chemical elements:

Zinc (Zn) 1 atom

Mercury Binding Sites:

The binding sites of Mercury atom in the X Ray Structure of the Complex Between Carbonic Anhydrase II and Lc Inhibitors (pdb code 3ffp). This binding sites where shown within 5.0 Angstroms radius around Mercury atom.
In total only one binding site of Mercury was determined in the X Ray Structure of the Complex Between Carbonic Anhydrase II and Lc Inhibitors, PDB code: 3ffp:

Mercury binding site 1 out of 1 in 3ffp

Go back to Mercury Binding Sites List in 3ffp
Mercury binding site 1 out of 1 in the X Ray Structure of the Complex Between Carbonic Anhydrase II and Lc Inhibitors


Mono view


Stereo pair view

A full contact list of Mercury with other atoms in the Hg binding site number 1 of X Ray Structure of the Complex Between Carbonic Anhydrase II and Lc Inhibitors within 5.0Å range:
probe atom residue distance (Å) B Occ
X:Hg263

b:19.7
occ:1.00
SG X:CYS206 1.5 2.0 0.5
C4 X:BEZ301 2.2 19.6 1.0
CB X:CYS206 2.9 6.5 0.5
O X:GLN137 2.9 9.6 1.0
O X:GLU205 3.0 7.8 1.0
C5 X:BEZ301 3.1 21.7 1.0
C3 X:BEZ301 3.2 19.0 1.0
CB X:CYS206 3.2 9.6 0.5
CA X:CYS206 3.4 6.1 0.5
C X:GLN137 3.4 10.1 1.0
C X:GLU205 3.4 8.1 1.0
CA X:CYS206 3.4 8.4 0.5
N X:CYS206 3.7 7.7 1.0
N X:GLN137 3.7 10.3 1.0
N X:PRO138 3.9 10.1 1.0
O X:VAL135 4.0 13.5 1.0
O X:HOH342 4.0 20.2 1.0
C X:GLN136 4.0 11.9 1.0
CA X:GLN137 4.1 9.8 1.0
CA X:PRO138 4.1 9.4 1.0
N X:GLU205 4.2 6.8 1.0
CA X:GLU205 4.4 7.4 1.0
C X:VAL135 4.4 12.0 1.0
C6 X:BEZ301 4.5 20.6 1.0
O X:GLN136 4.5 11.6 1.0
C2 X:BEZ301 4.5 20.8 1.0
CA X:GLN136 4.6 12.4 1.0
SG X:CYS206 4.7 14.6 0.5
N X:GLN136 4.8 11.9 1.0
C X:CYS206 4.9 7.2 1.0
CD X:PRO138 4.9 10.3 1.0
C X:LEU204 4.9 6.8 1.0
O X:HOH413 4.9 26.1 1.0
CB X:GLU205 5.0 8.4 1.0
CB X:LEU204 5.0 5.9 1.0

Reference:

L.Crocetti, A.Maresca, C.Temperini, R.A.Hall, A.Scozzafava, F.A.Muhlschlegel, C.T.Supuran. A Thiabendazole Sulfonamide Shows Potent Inhibitory Activity Against Mammalian and Nematode Alpha-Carbonic Anhydrases Bioorg.Med.Chem.Lett. V. 19 1371 2009.
ISSN: ISSN 0960-894X
PubMed: 19186056
DOI: 10.1016/J.BMCL.2009.01.038
Page generated: Sun Dec 13 19:09:20 2020

Last articles

Zn in 7VD8
Zn in 7V1R
Zn in 7V1Q
Zn in 7VPF
Zn in 7T85
Zn in 7T5F
Zn in 7NF9
Zn in 7M4M
Zn in 7M4O
Zn in 7M4N
© Copyright 2008-2020 by atomistry.com
Home   |    Site Map   |    Copyright   |    Contact us   |    Privacy