Fluorine in PDB 2wfg: Structure of the Candida Albicans Cytosolic Leucyl-Trna Synthetase Editing Domain Bound to A Benzoxaborole-Amp Adduct

The structure of Structure of the Candida Albicans Cytosolic Leucyl-Trna Synthetase Editing Domain Bound to A Benzoxaborole-Amp Adduct, PDB code: 2wfg was solved by E.Seiradake, W.Mao, V.Hernandez, S.J.Baker, J.J.Plattner, M.R.K.Alley, S.Cusack, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	49.88 / 2.20
Space group	P 21 21 21
Cell size a, b, c (Å), α, β, γ (°)	43.020, 58.040, 97.550, 90.00, 90.00, 90.00
R / Rfree (%)	18.45 / 26.155

The binding sites of Fluorine atom in the Structure of the Candida Albicans Cytosolic Leucyl-Trna Synthetase Editing Domain Bound to A Benzoxaborole-Amp Adduct (pdb code 2wfg). This binding sites where shown within 5.0 Angstroms radius around Fluorine atom.
In total only one binding site of Fluorine was determined in the Structure of the Candida Albicans Cytosolic Leucyl-Trna Synthetase Editing Domain Bound to A Benzoxaborole-Amp Adduct, PDB code: 2wfg:

Fluorine binding site 1 out of 1 in the Structure of the Candida Albicans Cytosolic Leucyl-Trna Synthetase Editing Domain Bound to A Benzoxaborole-Amp Adduct


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 1 of Structure of the Candida Albicans Cytosolic Leucyl-Trna Synthetase Editing Domain Bound to A Benzoxaborole-Amp Adduct within 5.0Å range: probe atom residue distance (Å) B Occ A:F1529 b:12.1 occ:1.00 F A:ZZB1529 0.0 12.1 1.0 CE1 A:ZZB1529 1.4 11.2 1.0 CD1 A:ZZB1529 2.4 10.0 1.0 CZ A:ZZB1529 2.4 11.3 1.0 ND A:ZZB1529 2.7 11.0 1.0 CB A:ASP418 3.1 9.6 1.0 C A:ASP418 3.1 9.8 1.0 O A:ASP418 3.2 9.9 1.0 N A:SER419 3.5 9.7 1.0 CG2 A:THR321 3.6 8.9 1.0 CA A:ASP418 3.6 9.8 1.0 CG A:ZZB1529 3.6 10.2 1.0 CE2 A:ZZB1529 3.7 9.6 1.0 NH1 A:ARG318 3.8 14.7 1.0 CB A:SER419 3.9 9.6 1.0 CD A:ARG318 4.0 14.2 1.0 CG1 A:VAL415 4.0 7.8 1.0 CA A:SER419 4.0 10.1 1.0 CB A:THR321 4.1 9.8 1.0 CD2 A:ZZB1529 4.1 9.4 1.0 OG1 A:THR321 4.2 9.4 1.0 CZ A:ARG318 4.2 15.3 1.0 CK A:ZZB1529 4.2 10.2 1.0 NE A:ARG318 4.2 14.8 1.0 CB A:VAL415 4.3 7.8 1.0 N A:ASP418 4.4 9.8 1.0 O A:VAL415 4.4 8.2 1.0 CG A:ASP418 4.5 11.2 1.0 CB A:ARG318 4.8 10.9 1.0 CF A:ZZB1529 4.8 9.8 1.0 CB A:ZZB1529 4.9 9.7 1.0 CG A:ARG318 4.9 12.2 1.0

E.Seiradake, W.Mao, V.Hernandez, S.J.Baker, J.J.Plattner, M.R.K.Alley, S.Cusack. Crystal Structures of the Human and Fungal Cytosolic Leucyl-Trna Synthetase Editing Domains: A Structural Basis For the Rational Design of Antifungal Benzoxaboroles. J.Mol.Biol. V. 390 196 2009.
ISSN: ISSN 0022-2836
PubMed: 19426743
DOI: 10.1016/J.JMB.2009.04.073