Atomistry » Gold » PDB 1a52-3k3g » 1hug
Atomistry »
  Gold »
    PDB 1a52-3k3g »
      1hug »

Gold in PDB 1hug: Differences in Anionic Inhibition of Human Carbonic Anhydrase I Revealed From the Structures of Iodide and Gold Cyanide Inhibitor Complexes

Enzymatic activity of Differences in Anionic Inhibition of Human Carbonic Anhydrase I Revealed From the Structures of Iodide and Gold Cyanide Inhibitor Complexes

All present enzymatic activity of Differences in Anionic Inhibition of Human Carbonic Anhydrase I Revealed From the Structures of Iodide and Gold Cyanide Inhibitor Complexes:
4.2.1.1;

Protein crystallography data

The structure of Differences in Anionic Inhibition of Human Carbonic Anhydrase I Revealed From the Structures of Iodide and Gold Cyanide Inhibitor Complexes, PDB code: 1hug was solved by V.Kumar, K.K.Kannan, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 8.00 / 2.00
Space group P 21 21 21
Cell size a, b, c (Å), α, β, γ (°) 81.800, 75.200, 37.100, 90.00, 90.00, 90.00
R / Rfree (%) n/a / n/a

Other elements in 1hug:

The structure of Differences in Anionic Inhibition of Human Carbonic Anhydrase I Revealed From the Structures of Iodide and Gold Cyanide Inhibitor Complexes also contains other interesting chemical elements:

Zinc (Zn) 1 atom

Gold Binding Sites:

The binding sites of Gold atom in the Differences in Anionic Inhibition of Human Carbonic Anhydrase I Revealed From the Structures of Iodide and Gold Cyanide Inhibitor Complexes (pdb code 1hug). This binding sites where shown within 5.0 Angstroms radius around Gold atom.
In total 4 binding sites of Gold where determined in the Differences in Anionic Inhibition of Human Carbonic Anhydrase I Revealed From the Structures of Iodide and Gold Cyanide Inhibitor Complexes, PDB code: 1hug:
Jump to Gold binding site number: 1; 2; 3; 4;

Gold binding site 1 out of 4 in 1hug

Go back to Gold Binding Sites List in 1hug
Gold binding site 1 out of 4 in the Differences in Anionic Inhibition of Human Carbonic Anhydrase I Revealed From the Structures of Iodide and Gold Cyanide Inhibitor Complexes


Mono view


Stereo pair view

A full contact list of Gold with other atoms in the Au binding site number 1 of Differences in Anionic Inhibition of Human Carbonic Anhydrase I Revealed From the Structures of Iodide and Gold Cyanide Inhibitor Complexes within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Au500

b:18.9
occ:0.51
AU A:AUC500 0.0 18.9 0.5
AU A:AUC501 1.5 12.3 0.1
C1 A:AUC500 2.1 18.7 1.0
C2 A:AUC500 2.3 20.8 0.6
N1 A:AUC500 3.3 22.1 0.8
N2 A:AUC500 3.4 17.3 1.0
O A:HOH286 3.5 19.1 1.0
CD2 A:LEU198 3.8 10.1 1.0
CZ A:PHE91 4.0 4.7 1.0
CB A:ALA121 4.3 2.0 1.0
CE2 A:PHE91 4.4 4.0 1.0
CD1 A:LEU141 4.5 14.6 1.0
O A:HOH423 4.5 2.0 0.4
OE1 A:GLN92 4.5 11.4 1.0
CE1 A:HIS94 4.7 6.1 1.0
O A:HOH300 4.9 23.9 1.0

Gold binding site 2 out of 4 in 1hug

Go back to Gold Binding Sites List in 1hug
Gold binding site 2 out of 4 in the Differences in Anionic Inhibition of Human Carbonic Anhydrase I Revealed From the Structures of Iodide and Gold Cyanide Inhibitor Complexes


Mono view


Stereo pair view

A full contact list of Gold with other atoms in the Au binding site number 2 of Differences in Anionic Inhibition of Human Carbonic Anhydrase I Revealed From the Structures of Iodide and Gold Cyanide Inhibitor Complexes within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Au501

b:12.3
occ:0.15
C2 A:AUC500 0.9 20.8 0.6
AU A:AUC500 1.5 18.9 0.5
N2 A:AUC500 1.9 17.3 1.0
O A:HOH286 3.4 19.1 1.0
C1 A:AUC500 3.6 18.7 1.0
CZ A:PHE91 3.7 4.7 1.0
CD2 A:LEU198 3.8 10.1 1.0
CE2 A:PHE91 3.9 4.0 1.0
CD1 A:LEU141 4.0 14.6 1.0
N1 A:AUC500 4.7 22.1 0.8
CD1 A:LEU198 4.8 12.1 1.0
CE1 A:PHE91 4.9 5.5 1.0
CG A:LEU198 4.9 13.9 1.0

Gold binding site 3 out of 4 in 1hug

Go back to Gold Binding Sites List in 1hug
Gold binding site 3 out of 4 in the Differences in Anionic Inhibition of Human Carbonic Anhydrase I Revealed From the Structures of Iodide and Gold Cyanide Inhibitor Complexes


Mono view


Stereo pair view

A full contact list of Gold with other atoms in the Au binding site number 3 of Differences in Anionic Inhibition of Human Carbonic Anhydrase I Revealed From the Structures of Iodide and Gold Cyanide Inhibitor Complexes within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Au502

b:38.6
occ:0.27
OD1 A:ASN178 2.4 27.9 1.0
CG A:ASN178 3.6 23.6 1.0
CB A:ALA54 3.9 19.9 1.0
O A:HOH386 3.9 43.2 1.0
N A:ALA54 3.9 14.7 1.0
CA A:ALA54 4.1 16.6 1.0
CG A:PRO53 4.2 16.0 1.0
CB A:ASN178 4.4 17.3 1.0
C A:PRO53 4.5 14.4 1.0
CB A:PRO53 4.6 15.4 1.0
ND2 A:ASN178 4.6 28.7 1.0
CA A:ASN178 4.7 14.1 1.0
OD1 A:ASN52 4.8 19.3 1.0
CA A:PRO53 4.9 14.9 1.0

Gold binding site 4 out of 4 in 1hug

Go back to Gold Binding Sites List in 1hug
Gold binding site 4 out of 4 in the Differences in Anionic Inhibition of Human Carbonic Anhydrase I Revealed From the Structures of Iodide and Gold Cyanide Inhibitor Complexes


Mono view


Stereo pair view

A full contact list of Gold with other atoms in the Au binding site number 4 of Differences in Anionic Inhibition of Human Carbonic Anhydrase I Revealed From the Structures of Iodide and Gold Cyanide Inhibitor Complexes within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Au503

b:58.5
occ:0.21
AU A:AUC503 0.0 58.5 0.2
C2 A:AUC503 2.1 54.6 1.0
C1 A:AUC503 2.1 55.2 1.0
ND2 A:ASN27 3.6 26.0 1.0
O A:HOH380 3.8 41.3 1.0
ND2 A:ASN26 3.9 35.2 1.0
O A:HOH298 4.2 23.1 1.0
CG A:ASN27 4.9 22.6 1.0
CG A:ASN26 5.0 29.4 1.0

Reference:

V.Kumar, K.K.Kannan, P.Sathyamurthi. Differences in Anionic Inhibition of Human Carbonic Anhydrase I Revealed From the Structures of Iodide and Gold Cyanide Inhibitor Complexes. Acta Crystallogr.,Sect.D V. 50 731 1994.
ISSN: ISSN 0907-4449
PubMed: 15299369
DOI: 10.1107/S0907444994001873
Page generated: Sat Dec 12 01:53:01 2020

Last articles

Zn in 8WB0
Zn in 8WAX
Zn in 8WAU
Zn in 8WAZ
Zn in 8WAY
Zn in 8WAV
Zn in 8WAW
Zn in 8WAT
Zn in 8W7M
Zn in 8WD3
© Copyright 2008-2020 by atomistry.com
Home   |    Site Map   |    Copyright   |    Contact us   |    Privacy