Gold in PDB 7yjp: Crystal Structure of Mcr-1 Treated By Aucl

The structure of Crystal Structure of Mcr-1 Treated By Aucl, PDB code: 7yjp was solved by Q.Zhang, M.Wang, H.Sun, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	58.09 / 1.88
Space group	P 1 21 1
Cell size a, b, c (Å), α, β, γ (°)	47.11, 83.54, 81.9, 90, 99.24, 90
R / Rfree (%)	20.2 / 24.5

The binding sites of Gold atom in the Crystal Structure of Mcr-1 Treated By Aucl (pdb code 7yjp). This binding sites where shown within 5.0 Angstroms radius around Gold atom.
In total 2 binding sites of Gold where determined in the Crystal Structure of Mcr-1 Treated By Aucl, PDB code: 7yjp:
Jump to Gold binding site number: 1; 2;

Gold binding site 1 out of 2 in the Crystal Structure of Mcr-1 Treated By Aucl


Mono view


Stereo pair view

A full contact list of Gold with other atoms in the Au binding site number 1 of Crystal Structure of Mcr-1 Treated By Aucl within 5.0Å range: probe atom residue distance (Å) B Occ A:Au601 b:69.3 occ:0.31 OE2 A:GLU246 2.2 42.4 1.0 OG1 A:TPO285 2.2 45.0 1.0 OD2 A:ASP465 2.2 34.0 1.0 NE2 A:HIS466 2.3 35.9 1.0 OE1 A:GLU246 2.4 36.7 1.0 O3P A:TPO285 2.5 49.9 1.0 CD A:GLU246 2.6 34.7 1.0 CE1 A:HIS466 2.7 34.6 1.0 P A:TPO285 2.9 57.6 1.0 CG A:ASP465 3.1 34.5 1.0 OD1 A:ASP465 3.3 32.3 1.0 CD2 A:HIS466 3.4 36.1 1.0 CB A:TPO285 3.4 45.7 1.0 N A:TPO285 3.8 38.7 1.0 O1P A:TPO285 3.8 46.6 1.0 CA A:TPO285 3.8 35.2 1.0 ND1 A:HIS466 3.9 32.2 1.0 CG2 A:TPO285 3.9 41.2 1.0 CG A:GLU246 4.1 35.6 1.0 O2P A:TPO285 4.1 38.2 1.0 NE2 A:HIS478 4.2 39.9 1.0 CG A:HIS466 4.2 30.4 1.0 O A:HOH703 4.2 37.8 1.0 OG1 A:THR247 4.3 30.1 1.0 CB A:ASP465 4.5 29.7 1.0 N A:THR247 4.6 39.2 1.0 CE1 A:HIS478 4.6 38.9 1.0 CD2 A:HIS395 4.7 48.4 1.0 C A:SER284 4.7 36.1 1.0 CA A:GLU246 4.8 25.9 1.0 CB A:GLU246 4.9 27.3 1.0 CD2 A:HIS478 4.9 31.6 1.0

Gold binding site 2 out of 2 in the Crystal Structure of Mcr-1 Treated By Aucl


Mono view


Stereo pair view

A full contact list of Gold with other atoms in the Au binding site number 2 of Crystal Structure of Mcr-1 Treated By Aucl within 5.0Å range: probe atom residue distance (Å) B Occ B:Au601 b:34.4 occ:0.12 OE2 B:GLU246 2.2 40.9 1.0 OG1 B:TPO285 2.2 52.9 1.0 OD2 B:ASP465 2.2 39.4 1.0 O3P B:TPO285 2.2 53.5 1.0 NE2 B:HIS466 2.3 42.6 1.0 OE1 B:GLU246 2.5 41.1 1.0 CD B:GLU246 2.7 43.0 1.0 P B:TPO285 2.7 53.3 1.0 CE1 B:HIS466 2.7 44.8 1.0 CG B:ASP465 3.2 36.8 1.0 CD2 B:HIS466 3.3 42.0 1.0 OD1 B:ASP465 3.5 36.1 1.0 CB B:TPO285 3.5 43.8 1.0 O1P B:TPO285 3.6 54.9 1.0 N B:TPO285 3.7 36.2 1.0 ND1 B:HIS466 3.8 34.7 1.0 CA B:TPO285 3.9 47.0 1.0 O2P B:TPO285 3.9 59.3 1.0 O B:HOH711 4.0 39.4 1.0 CG2 B:TPO285 4.1 43.2 1.0 CG B:HIS466 4.2 35.3 1.0 CG B:GLU246 4.2 37.6 1.0 OG1 B:THR247 4.2 45.8 1.0 NE2 B:HIS478 4.4 57.6 1.0 CB B:ASP465 4.5 39.0 1.0 C B:SER284 4.6 41.2 1.0 N B:THR247 4.6 36.4 1.0 CE1 B:HIS478 4.8 51.4 1.0 ND1 B:HIS395 4.9 55.3 1.0 CA B:GLU246 4.9 29.9 1.0 CB B:GLU246 5.0 30.0 1.0

Q.Zhang, M.Wang, X.Hu, A.Yan, P.L.Ho, H.Li, H.Sun. Gold Drugs As Colistin Adjuvants in the Fight Against Mcr-1 Producing Bacteria. J.Biol.Inorg.Chem. 2023.
ISSN: ESSN 1432-1327
PubMed: 36662362
DOI: 10.1007/S00775-022-01983-Y