Fluorine in PDB 2wqq: Crystallographic Analysis of Monomeric Cstii

The structure of Crystallographic Analysis of Monomeric Cstii, PDB code: 2wqq was solved by P.H.W.Chan, L.L.Lairson, H.J.Lee, W.W.Wakarchuk, N.C.J.Strynadka, S.G.Withers, L.P.Mcintosh, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	34.00 / 2.25
Space group	I 4
Cell size a, b, c (Å), α, β, γ (°)	116.634, 116.634, 45.385, 90.00, 90.00, 90.00
R / Rfree (%)	17.659 / 21.863

The binding sites of Fluorine atom in the Crystallographic Analysis of Monomeric Cstii (pdb code 2wqq). 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 Crystallographic Analysis of Monomeric Cstii, PDB code: 2wqq:

Fluorine binding site 1 out of 1 in the Crystallographic Analysis of Monomeric Cstii


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 1 of Crystallographic Analysis of Monomeric Cstii within 5.0Å range: probe atom residue distance (Å) B Occ A:F1259 b:49.0 occ:1.00 F3A A:CSF1259 0.0 49.0 1.0 C3A A:CSF1259 1.4 47.3 1.0 C4A A:CSF1259 2.4 48.3 1.0 C2A A:CSF1259 2.4 44.3 1.0 C1A A:CSF1259 2.6 41.6 1.0 O4A A:CSF1259 2.7 49.4 1.0 OAA A:CSF1259 2.9 44.1 1.0 C5A A:CSF1259 3.0 49.4 1.0 CE1 A:HIS188 3.0 36.8 1.0 O6A A:CSF1259 3.1 45.1 1.0 OBA A:CSF1259 3.2 39.7 1.0 NE2 A:HIS188 3.2 35.7 1.0 O1A A:CSF1259 3.5 43.0 1.0 C6A A:CSF1259 3.6 45.9 1.0 OH A:TYR156 4.0 38.0 1.0 O A:HOH2057 4.0 34.2 1.0 ND1 A:HIS188 4.1 36.1 1.0 N5A A:CSF1259 4.3 54.2 1.0 CD2 A:HIS188 4.3 35.8 1.0 O3' A:CSF1259 4.4 50.9 1.0 O7A A:CSF1259 4.5 44.6 1.0 C7A A:CSF1259 4.7 44.0 1.0 CG A:HIS188 4.7 34.2 1.0 CG2 A:THR131 4.8 13.0 1.0 ND2 A:ASN51 4.8 24.0 1.0 PA A:CSF1259 4.9 41.3 1.0 CA A:THR131 4.9 12.9 1.0 O2A A:CSF1259 5.0 44.6 1.0

P.H.W.Chan, L.L.Lairson, H.J.Lee, W.W.Wakarchuk, N.C.J.Strynadka, S.G.Withers, L.P.Mcintosh. uc(Nmr) Spectroscopic Characterization of the Sialyltransferase Cstii From Camplyobacter Jejuni: Histidine 188 Is the General Base. Biochemistry V. 48 11220 2009.
ISSN: ISSN 0006-2960
PubMed: 19824695
DOI: 10.1021/BI901606N