Chlorine in PDB 4n14: Crystal Structure of CDC20 and Apcin Complex

The structure of Crystal Structure of CDC20 and Apcin Complex, PDB code: 4n14 was solved by X.Luo, W.Tian, H.Yu, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	28.58 / 2.10
Space group	P 1 21 1
Cell size a, b, c (Å), α, β, γ (°)	41.041, 87.177, 48.043, 90.00, 112.72, 90.00
R / Rfree (%)	16.5 / 21.3

The binding sites of Chlorine atom in the Crystal Structure of CDC20 and Apcin Complex (pdb code 4n14). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 3 binding sites of Chlorine where determined in the Crystal Structure of CDC20 and Apcin Complex, PDB code: 4n14:
Jump to Chlorine binding site number: 1; 2; 3;

Chlorine binding site 1 out of 3 in the Crystal Structure of CDC20 and Apcin Complex


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Crystal Structure of CDC20 and Apcin Complex within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl501 b:55.2 occ:1.00 CL1 A:WR7501 0.0 55.2 1.0 C6 A:WR7501 1.7 42.6 1.0 C5 A:WR7501 2.6 30.6 1.0 H5 A:WR7501 2.8 36.7 1.0 HN4 A:WR7501 2.8 40.2 1.0 CL2 A:WR7501 2.8 49.8 1.0 CL3 A:WR7501 2.8 48.4 1.0 HB2 A:TYR207 2.9 30.2 1.0 N4 A:WR7501 3.0 33.5 1.0 HB3 A:TYR207 3.1 30.2 1.0 O2 A:WR7501 3.2 32.1 1.0 HB A:VAL200 3.3 34.7 1.0 C7 A:WR7501 3.3 27.8 1.0 CB A:TYR207 3.4 25.2 1.0 HG21 A:VAL200 3.6 39.6 1.0 HB2 A:TRP209 3.6 35.6 1.0 N3 A:WR7501 3.9 37.1 1.0 HG12 A:ILE216 4.0 50.7 1.0 CB A:VAL200 4.1 28.9 1.0 HG23 A:VAL200 4.1 39.6 1.0 CG2 A:VAL200 4.1 33.0 1.0 HG11 A:VAL200 4.2 35.0 1.0 HD11 A:LEU202 4.2 30.6 1.0 CG A:TYR207 4.3 25.9 1.0 HN3 A:WR7501 4.3 44.5 1.0 O A:TYR207 4.5 21.5 1.0 HG23 A:ILE216 4.5 39.8 1.0 HG13 A:ILE216 4.5 50.7 1.0 O1 A:WR7501 4.5 37.3 1.0 CB A:TRP209 4.5 29.7 1.0 C A:TYR207 4.5 23.3 1.0 CA A:TYR207 4.6 20.9 1.0 HB3 A:TRP209 4.6 35.6 1.0 CG1 A:VAL200 4.6 29.2 1.0 HD12 A:LEU202 4.7 30.6 1.0 CG1 A:ILE216 4.7 42.2 1.0 HG21 A:ILE216 4.8 39.8 1.0 HD1 A:TYR207 4.9 35.4 1.0 CD1 A:LEU202 4.9 25.5 1.0 HD2 A:TYR207 4.9 29.0 1.0 CD1 A:TYR207 4.9 29.5 1.0 HG12 A:VAL200 4.9 35.0 1.0 CD2 A:TYR207 4.9 24.2 1.0 HG A:LEU202 4.9 27.1 1.0 N2 A:WR7501 5.0 51.4 1.0 C2 A:WR7501 5.0 44.8 1.0

Chlorine binding site 2 out of 3 in the Crystal Structure of CDC20 and Apcin Complex


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of Crystal Structure of CDC20 and Apcin Complex within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl501 b:49.8 occ:1.00 CL2 A:WR7501 0.0 49.8 1.0 C6 A:WR7501 1.7 42.6 1.0 C5 A:WR7501 2.6 30.6 1.0 HD13 A:LEU176 2.7 41.8 1.0 HB2 A:TRP209 2.7 35.6 1.0 H5 A:WR7501 2.8 36.7 1.0 CL1 A:WR7501 2.8 55.2 1.0 CL3 A:WR7501 2.8 48.4 1.0 N3 A:WR7501 3.0 37.1 1.0 HB3 A:LEU176 3.2 36.4 1.0 HN3 A:WR7501 3.3 44.5 1.0 CB A:TRP209 3.4 29.7 1.0 N2 A:WR7501 3.4 51.4 1.0 CG A:TRP209 3.4 34.6 1.0 HD22 A:LEU176 3.4 39.1 1.0 HB3 A:TRP209 3.5 35.6 1.0 C2 A:WR7501 3.5 44.8 1.0 CD1 A:TRP209 3.6 35.2 1.0 CD1 A:LEU176 3.7 34.9 1.0 HD1 A:TRP209 3.7 42.3 1.0 N4 A:WR7501 4.0 33.5 1.0 CB A:LEU176 4.0 30.4 1.0 CD2 A:TRP209 4.0 27.6 1.0 HN4 A:WR7501 4.1 40.2 1.0 HD12 A:LEU176 4.1 41.8 1.0 CG A:LEU176 4.1 36.6 1.0 HG21 A:VAL200 4.1 39.6 1.0 HG12 A:ILE216 4.1 50.7 1.0 CD2 A:LEU176 4.2 32.6 1.0 HG13 A:ILE216 4.2 50.7 1.0 HD11 A:LEU176 4.2 41.8 1.0 HB2 A:LEU176 4.2 36.4 1.0 HD11 A:ILE216 4.3 68.9 1.0 NE1 A:TRP209 4.4 39.8 1.0 C3 A:WR7501 4.5 51.6 1.0 CG1 A:ILE216 4.6 42.2 1.0 CE2 A:TRP209 4.6 24.8 1.0 HD21 A:LEU176 4.6 39.1 1.0 O2 A:WR7501 4.6 32.1 1.0 N1 A:WR7501 4.7 45.9 1.0 CE3 A:TRP209 4.8 29.7 1.0 CA A:TRP209 4.8 26.1 1.0 H3 A:WR7501 4.8 61.9 1.0 HE3 A:TRP209 4.8 35.6 1.0 C7 A:WR7501 4.8 27.8 1.0 HD23 A:LEU176 4.8 39.1 1.0 HE1 A:TRP209 4.9 47.8 1.0 HG23 A:VAL200 4.9 39.6 1.0 CD1 A:ILE216 4.9 57.4 1.0 CG2 A:VAL200 5.0 33.0 1.0 HA A:TRP209 5.0 31.3 1.0

Chlorine binding site 3 out of 3 in the Crystal Structure of CDC20 and Apcin Complex


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 3 of Crystal Structure of CDC20 and Apcin Complex within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl501 b:48.4 occ:1.00 CL3 A:WR7501 0.0 48.4 1.0 C6 A:WR7501 1.7 42.6 1.0 HN4 A:WR7501 2.5 40.2 1.0 C5 A:WR7501 2.6 30.6 1.0 HN3 A:WR7501 2.7 44.5 1.0 CL1 A:WR7501 2.8 55.2 1.0 CL2 A:WR7501 2.8 49.8 1.0 N3 A:WR7501 3.0 37.1 1.0 N4 A:WR7501 3.0 33.5 1.0 HG21 A:VAL200 3.2 39.6 1.0 HG11 A:VAL200 3.3 35.0 1.0 O A:ASP177 3.3 27.1 1.0 HB3 A:LEU176 3.4 36.4 1.0 H5 A:WR7501 3.5 36.7 1.0 HB2 A:LEU176 3.7 36.4 1.0 HD13 A:LEU467 3.7 43.1 1.0 HA A:ALA178 3.8 28.7 1.0 HB2 A:ALA178 3.8 31.0 1.0 HD13 A:LEU176 3.9 41.8 1.0 CB A:LEU176 4.0 30.4 1.0 HD11 A:LEU202 4.0 30.6 1.0 CG2 A:VAL200 4.1 33.0 1.0 HB A:VAL200 4.1 34.7 1.0 HD22 A:LEU467 4.1 44.7 1.0 CG1 A:VAL200 4.1 29.2 1.0 HB2 A:LEU467 4.1 40.6 1.0 C A:ASP177 4.2 29.1 1.0 C7 A:WR7501 4.2 27.8 1.0 C2 A:WR7501 4.3 44.8 1.0 CB A:VAL200 4.3 28.9 1.0 CA A:ALA178 4.4 23.9 1.0 HD12 A:LEU176 4.5 41.8 1.0 CB A:ALA178 4.5 25.8 1.0 HD21 A:LEU202 4.6 27.4 1.0 HG23 A:VAL200 4.6 39.6 1.0 CD1 A:LEU176 4.6 34.9 1.0 CD1 A:LEU467 4.6 36.0 1.0 HG22 A:VAL200 4.7 39.6 1.0 HG12 A:VAL200 4.7 35.0 1.0 N A:ALA178 4.7 27.8 1.0 HG13 A:VAL200 4.7 35.0 1.0 HB1 A:ALA178 4.7 31.0 1.0 C A:LEU176 4.7 23.7 1.0 O2 A:WR7501 4.7 32.1 1.0 N A:ASP177 4.8 29.6 1.0 CG A:LEU176 4.9 36.6 1.0 CD2 A:LEU467 5.0 37.2 1.0 N2 A:WR7501 5.0 51.4 1.0 CD1 A:LEU202 5.0 25.5 1.0 HD2 A:PRO179 5.0 35.8 1.0 CB A:LEU467 5.0 33.8 1.0 O A:LEU176 5.0 28.1 1.0 H A:ASP177 5.0 35.6 1.0 CA A:LEU176 5.0 29.4 1.0

K.L.Sackton, N.Dimova, X.Zeng, W.Tian, M.Zhang, T.B.Sackton, J.Meaders, K.L.Pfaff, F.Sigoillot, H.Yu, X.Luo, R.W.King. Synergistic Blockade of Mitotic Exit By Two Chemical Inhibitors of the Apc/C. Nature V. 514 646 2014.
ISSN: ISSN 0028-0836
PubMed: 25156254
DOI: 10.1038/NATURE13660