Zinc in PDB 8uk6: Candida Albicans Glutaminyl Trna Synthetase (GLN4) in Complex with N- Pyrimidinyl-Beta-Thiophenylacrylamide

The structure of Candida Albicans Glutaminyl Trna Synthetase (GLN4) in Complex with N- Pyrimidinyl-Beta-Thiophenylacrylamide, PDB code: 8uk6 was solved by D.Sychantha, G.D.Wright, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	45.99 / 2.73
Space group	I 4 2 2
Cell size a, b, c (Å), α, β, γ (°)	143.09, 143.09, 145.71, 90, 90, 90
R / Rfree (%)	20.3 / 24.1

The binding sites of Zinc atom in the Candida Albicans Glutaminyl Trna Synthetase (GLN4) in Complex with N- Pyrimidinyl-Beta-Thiophenylacrylamide (pdb code 8uk6). 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 Candida Albicans Glutaminyl Trna Synthetase (GLN4) in Complex with N- Pyrimidinyl-Beta-Thiophenylacrylamide, PDB code: 8uk6:

Zinc binding site 1 out of 1 in the Candida Albicans Glutaminyl Trna Synthetase (GLN4) in Complex with N- Pyrimidinyl-Beta-Thiophenylacrylamide


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 1 of Candida Albicans Glutaminyl Trna Synthetase (GLN4) in Complex with N- Pyrimidinyl-Beta-Thiophenylacrylamide within 5.0Å range: probe atom residue distance (Å) B Occ A:Zn801 b:109.8 occ:1.00 SG A:CYS346 2.3 114.5 1.0 ND1 A:HIS374 2.3 115.2 1.0 SG A:CYS348 2.3 118.4 1.0 CB A:CYS372 2.7 119.7 1.0 CE1 A:HIS374 2.9 111.4 1.0 SG A:CYS372 3.1 129.9 1.0 CG A:HIS374 3.5 115.7 1.0 CB A:CYS346 3.9 101.5 1.0 CB A:CYS348 3.9 112.7 1.0 CA A:CYS372 4.1 113.2 1.0 CB A:HIS374 4.1 113.8 1.0 NE2 A:HIS374 4.2 112.4 1.0 N A:HIS374 4.4 110.3 1.0 CD2 A:HIS374 4.5 114.5 1.0 C A:CYS372 4.5 112.5 1.0 CA A:CYS346 4.5 105.9 1.0 N A:LYS373 4.6 112.8 1.0 N A:CYS348 4.6 112.2 1.0 N A:HIS347 4.7 108.9 1.0 CA A:CYS348 4.8 115.5 1.0 NH1 A:ARG402 4.8 96.7 1.0 CA A:HIS374 4.9 111.8 1.0

E.Puumala, D.Sychantha, E.Lach, S.Reeves, S.Nabeela, M.Fogal, A.Nigam, J.W.Johnson, A.Aspuru-Guzik, R.S.Shapiro, P.Uppuluri, S.Kalyaanamoorthy, J.Magolan, L.Whitesell, N.Robbins, G.D.Wright, L.E.Cowen. Allosteric Inhibition of Trna Synthetase GLN4 By N-Pyrimidinyl-Beta-Thiophenylacrylamides Exerts Highly Selective Antifungal Activity. Cell Chem Biol 2024.
ISSN: ESSN 2451-9456
PubMed: 38402621
DOI: 10.1016/J.CHEMBIOL.2024.01.010