Cobalt in PDB 5ydj: Crystal Structure of Anopheles Gambiae Acetylcholinesterase in Complex with Pmsf

All present enzymatic activity of Crystal Structure of Anopheles Gambiae Acetylcholinesterase in Complex with Pmsf:
3.1.1.7;

The structure of Crystal Structure of Anopheles Gambiae Acetylcholinesterase in Complex with Pmsf, PDB code: 5ydj was solved by Q.Han, H.Guan, H.Ding, C.Liao, H.Robinson, J.Li, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	61.48 / 3.04
Space group	P 61
Cell size a, b, c (Å), α, β, γ (°)	147.650, 147.650, 224.180, 90.00, 90.00, 120.00
R / Rfree (%)	25.1 / 28.6

The binding sites of Cobalt atom in the Crystal Structure of Anopheles Gambiae Acetylcholinesterase in Complex with Pmsf (pdb code 5ydj). This binding sites where shown within 5.0 Angstroms radius around Cobalt atom.
In total 2 binding sites of Cobalt where determined in the Crystal Structure of Anopheles Gambiae Acetylcholinesterase in Complex with Pmsf, PDB code: 5ydj:
Jump to Cobalt binding site number: 1; 2;

Cobalt binding site 1 out of 2 in the Crystal Structure of Anopheles Gambiae Acetylcholinesterase in Complex with Pmsf


Mono view


Stereo pair view

A full contact list of Cobalt with other atoms in the Co binding site number 1 of Crystal Structure of Anopheles Gambiae Acetylcholinesterase in Complex with Pmsf within 5.0Å range: probe atom residue distance (Å) B Occ A:Co817 b:0.4 occ:1.00 O A:HOH906 1.7 58.1 1.0 O A:HOH916 1.8 50.2 1.0 NE2 A:HIS416 1.8 94.2 1.0 CE1 A:HIS416 2.2 86.5 1.0 CD2 A:HIS416 3.0 88.4 1.0 ND1 A:HIS416 3.3 87.0 1.0 CG A:HIS416 3.7 88.2 1.0 O A:HOH923 3.8 33.7 1.0 OE2 A:GLU410 4.2 68.2 1.0 CD A:GLU410 4.9 64.0 1.0 CG A:GLU410 5.0 62.6 1.0

Cobalt binding site 2 out of 2 in the Crystal Structure of Anopheles Gambiae Acetylcholinesterase in Complex with Pmsf


Mono view


Stereo pair view

A full contact list of Cobalt with other atoms in the Co binding site number 2 of Crystal Structure of Anopheles Gambiae Acetylcholinesterase in Complex with Pmsf within 5.0Å range: probe atom residue distance (Å) B Occ B:Co820 b:0.4 occ:1.00 O B:HOH917 1.7 43.1 1.0 O B:HOH916 1.7 44.6 1.0 NE2 B:HIS416 1.8 0.8 1.0 CE1 B:HIS416 2.5 95.2 1.0 CD2 B:HIS416 3.0 91.8 1.0 OE2 B:GLU410 3.3 74.1 1.0 ND1 B:HIS416 3.6 86.7 1.0 CG B:HIS416 3.9 80.3 1.0 CD B:GLU410 4.1 76.9 1.0 CG B:GLU410 4.6 77.0 1.0 OE1 B:GLU410 4.9 73.5 1.0

Q.Han, H.Guan, H.Ding, C.Liao, H.Robinson, J.Li. Crystal Structures of Acetylcholinesterase of the Malaria Vector Anopheles Gambiae Reveal A Polymerization Interface, Ligand Binding Residues and Post Translational Modifications To Be Published.