Chlorine in PDB 4uwy: FGFR1 Apo Structure

All present enzymatic activity of FGFR1 Apo Structure:
2.7.10.1;

The structure of FGFR1 Apo Structure, PDB code: 4uwy was solved by N.Thiyagarajan, T.Bunney, M.Katan, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	27.815 / 2.30
Space group	C 1 2 1
Cell size a, b, c (Å), α, β, γ (°)	211.837, 49.792, 66.054, 90.00, 107.40, 90.00
R / Rfree (%)	21.14 / 26.66

The binding sites of Chlorine atom in the FGFR1 Apo Structure (pdb code 4uwy). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 3 binding sites of Chlorine where determined in the FGFR1 Apo Structure, PDB code: 4uwy:
Jump to Chlorine binding site number: 1; 2; 3;

Chlorine binding site 1 out of 3 in the FGFR1 Apo Structure


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of FGFR1 Apo Structure within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl1764 b:66.4 occ:1.00 NH1 A:ARG661 3.3 62.4 1.0 OD1 A:ASN659 3.3 81.9 1.0 CG2 A:THR657 4.0 65.9 1.0 CG A:ASN659 4.1 84.6 1.0 CB A:ARG627 4.1 36.0 1.0 NE A:ARG627 4.2 64.1 1.0 CB A:ASN659 4.3 83.0 1.0 OG1 A:THR657 4.4 87.2 1.0 CZ A:ARG661 4.6 45.3 1.0 NH2 A:ARG627 4.6 71.4 1.0 CG A:ARG627 4.7 52.1 1.0 CB A:THR657 4.8 75.4 1.0 CB A:ARG661 4.8 58.0 1.0 OD1 A:ASN628 4.9 40.7 1.0 CZ A:ARG627 4.9 68.2 1.0

Chlorine binding site 2 out of 3 in the FGFR1 Apo Structure


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of FGFR1 Apo Structure within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl1765 b:52.4 occ:1.00 OG A:SER699 3.8 47.2 1.0 CG A:ARG661 3.8 52.9 1.0 NH2 A:ARG570 3.9 51.8 1.0 NH1 A:ARG570 3.9 54.1 1.0 N A:LEU662 4.1 57.3 1.0 CA A:ARG661 4.2 64.0 1.0 CH2 A:TRP666 4.2 31.9 1.0 NZ A:LYS665 4.2 55.6 1.0 CZ3 A:TRP666 4.4 32.0 1.0 CZ A:ARG570 4.4 55.6 1.0 CB A:ARG661 4.5 58.0 1.0 CD A:LYS665 4.5 42.5 1.0 C A:ARG661 4.7 63.8 1.0 CD A:PRO700 4.7 40.6 1.0 O A:GLY660 4.7 71.5 1.0 CB A:SER699 4.9 35.8 1.0 CD A:ARG661 4.9 51.5 1.0 CE A:LYS665 5.0 53.3 1.0

Chlorine binding site 3 out of 3 in the FGFR1 Apo Structure


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 3 of FGFR1 Apo Structure within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl1766 b:60.2 occ:1.00 O A:HOH2060 3.0 41.6 1.0 OG A:SER584 3.4 59.1 1.0 N A:SER699 3.8 39.7 1.0 NH2 A:ARG577 3.9 50.3 1.0 CB A:SER584 3.9 59.4 1.0 CA A:GLY698 4.0 39.3 1.0 O A:HOH2037 4.3 45.3 1.0 C A:GLY698 4.4 41.6 1.0 CB A:SER699 4.6 35.8 1.0 NH1 A:ARG577 4.7 43.8 1.0 CA A:SER699 4.8 37.2 1.0 CZ A:ARG577 4.8 50.6 1.0

T.Bunney, S.Wan, N.Thiyagarajan, L.Sutto, S.V.Williams, P.Ashford, H.Koss, M.A.Knowles, F.L.Gervasio, P.V.Coveney, M.Katan. The Effect of Mutations on Drug Sensitivity and Kinase Activity of Fibroblast Growth Factor Receptors: A Combined Experimental and Theoretical Study Ebiomedicine 2015.
ISSN: ESSN 2352-3964
DOI: 10.1016/J.EBIOM.2015.02.009