Fluorine in PDB 4cup: Crystal Structure of Human BAZ2B in Complex with Fragment-1 N09421

The structure of Crystal Structure of Human BAZ2B in Complex with Fragment-1 N09421, PDB code: 4cup was solved by A.R.Bradley, Y.Liu, T.Krojer, C.Bountra, C.H.Arrowsmith, A.Edwards, S.Knapp, F.Von Delft, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	18.538 / 1.88
Space group	C 2 2 21
Cell size a, b, c (Å), α, β, γ (°)	80.370, 96.120, 57.670, 90.00, 90.00, 90.00
R / Rfree (%)	17.63 / 20.78

The binding sites of Fluorine atom in the Crystal Structure of Human BAZ2B in Complex with Fragment-1 N09421 (pdb code 4cup). 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 Crystal Structure of Human BAZ2B in Complex with Fragment-1 N09421, PDB code: 4cup:

Fluorine binding site 1 out of 1 in the Crystal Structure of Human BAZ2B in Complex with Fragment-1 N09421


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 1 of Crystal Structure of Human BAZ2B in Complex with Fragment-1 N09421 within 5.0Å range: probe atom residue distance (Å) B Occ A:F2971 b:57.7 occ:1.00 F A:ZYB2971 0.0 57.7 1.0 C2 A:ZYB2971 1.3 57.0 1.0 C1 A:ZYB2971 2.3 55.8 1.0 C3 A:ZYB2971 2.3 52.8 1.0 H1 A:ZYB2971 2.5 66.9 1.0 H3 A:ZYB2971 2.5 63.4 1.0 C A:ZYB2971 3.6 45.4 1.0 C4 A:ZYB2971 3.6 44.4 1.0 CG1 A:VAL1898 3.6 42.1 1.0 CG2 A:VAL1893 3.8 34.8 1.0 CG1 A:VAL1893 3.8 37.6 1.0 CG2 A:VAL1898 3.9 40.1 1.0 C A:MOH2972 4.0 20.0 1.0 O A:MOH2972 4.0 23.9 1.0 C5 A:ZYB2971 4.1 44.6 1.0 CD2 A:TYR1901 4.3 30.4 1.0 CB A:VAL1898 4.3 42.7 1.0 H4 A:ZYB2971 4.3 53.3 1.0 H A:ZYB2971 4.3 54.5 1.0 CE2 A:TYR1901 4.4 34.5 1.0 CB A:VAL1893 4.4 35.6 1.0 CE2 A:PHE1943 4.5 31.0 1.0 O A:HOH2060 4.5 50.1 1.0 O A:HOH2008 4.6 67.6 1.0 CD2 A:PHE1943 4.7 29.8 1.0

A.R Bradley, Y.Liu, T.Krojer, C.Bountra, C.H.Arrowsmith, A.Edwards, S.Knapp, F.Von Delft. Crystal Structure of Human BAZ2B in Complex with Fragment-1 N09421 To Be Published.