Chlorine in PDB 4ceg: Crystal Structure of Aurora A 122-403 C290A, C393A Bound to Adp

The structure of Crystal Structure of Aurora A 122-403 C290A, C393A Bound to Adp, PDB code: 4ceg was solved by S.G.Burgess, R.Bayliss, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	70.105 / 2.10
Space group	P 61 2 2
Cell size a, b, c (Å), α, β, γ (°)	80.950, 80.950, 174.530, 90.00, 90.00, 120.00
R / Rfree (%)	19.98 / 23.75

The structure of Crystal Structure of Aurora A 122-403 C290A, C393A Bound to Adp also contains other interesting chemical elements:

Magnesium

(Mg)

2 atoms

The binding sites of Chlorine atom in the Crystal Structure of Aurora A 122-403 C290A, C393A Bound to Adp (pdb code 4ceg). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 4 binding sites of Chlorine where determined in the Crystal Structure of Aurora A 122-403 C290A, C393A Bound to Adp, PDB code: 4ceg:
Jump to Chlorine binding site number: 1; 2; 3; 4;

Chlorine binding site 1 out of 4 in the Crystal Structure of Aurora A 122-403 C290A, C393A Bound to Adp


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 Aurora A 122-403 C290A, C393A Bound to Adp within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl1397 b:36.7 occ:0.50 N A:SER284 3.2 36.4 1.0 NE A:ARG286 3.6 41.4 1.0 CB A:SER284 3.6 41.1 1.0 NH2 A:ARG286 3.6 35.6 1.0 OG A:SER283 3.7 39.2 1.0 CA A:SER284 3.9 35.6 1.0 CZ A:ARG286 4.0 40.0 1.0 O2 A:GOL1393 4.0 40.8 1.0 O A:SER284 4.0 37.6 1.0 C A:SER283 4.2 37.3 1.0 C A:SER284 4.2 37.9 1.0 CA A:SER283 4.2 33.2 1.0 CB A:SER283 4.6 36.7 1.0 CG A:ARG286 4.6 43.0 1.0 CD A:ARG286 4.7 38.8 1.0 OG A:SER284 4.8 47.7 1.0

Chlorine binding site 2 out of 4 in the Crystal Structure of Aurora A 122-403 C290A, C393A Bound to Adp


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 Aurora A 122-403 C290A, C393A Bound to Adp within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl1398 b:39.7 occ:1.00 NH2 A:ARG255 3.1 31.1 1.0 N A:ARG286 3.2 40.7 1.0 OG1 A:THR287 3.6 46.9 1.0 N A:THR287 3.6 42.3 1.0 CA A:ARG285 3.9 35.8 1.0 NH1 A:ARG255 4.0 28.7 1.0 CZ A:ARG255 4.0 31.3 1.0 C A:ARG285 4.1 39.1 1.0 CA A:ARG286 4.1 42.4 1.0 CB A:THR287 4.1 46.1 1.0 CZ3 A:TRP277 4.2 34.1 1.0 CB A:ARG286 4.2 43.2 1.0 O A:SER284 4.2 37.6 1.0 CG A:ARG286 4.3 43.0 1.0 C A:ARG286 4.4 47.6 1.0 CG A:ARG285 4.4 38.5 1.0 CA A:THR287 4.5 45.6 1.0 CE3 A:TRP277 4.6 33.9 1.0 CB A:ARG285 4.7 34.9 1.0 CE1 A:HIS176 4.9 33.5 1.0 N A:ARG285 5.0 38.7 1.0

Chlorine binding site 3 out of 4 in the Crystal Structure of Aurora A 122-403 C290A, C393A Bound to Adp


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 Aurora A 122-403 C290A, C393A Bound to Adp within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl1399 b:52.5 occ:1.00 N A:ARG375 3.3 38.8 1.0 CG A:MET373 3.3 56.6 1.0 N A:LEU374 3.6 35.1 1.0 CB A:ARG375 3.8 40.7 1.0 CB A:MET373 3.8 41.2 1.0 CB A:LEU374 4.0 34.5 1.0 CA A:ARG375 4.1 40.0 1.0 CA A:LEU374 4.1 35.3 1.0 C A:LEU374 4.1 36.4 1.0 C A:MET373 4.3 34.8 1.0 CA A:MET373 4.4 39.2 1.0 O A:HOH2031 4.9 41.7 1.0 SD A:MET373 4.9 66.7 1.0

Chlorine binding site 4 out of 4 in the Crystal Structure of Aurora A 122-403 C290A, C393A Bound to Adp


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 4 of Crystal Structure of Aurora A 122-403 C290A, C393A Bound to Adp within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl1400 b:70.0 occ:1.00 CD1 A:PHE157 4.7 34.8 1.0 O A:HOH2069 4.9 49.3 1.0

S.G.Burgess, R.Bayliss. Structure of Aurora A 122-403 C290A, C393A Bound to Adp To Be Published.