Bromine in PDB 1yiz: Aedes Aegypti Kynurenine Aminotrasferase

All present enzymatic activity of Aedes Aegypti Kynurenine Aminotrasferase:
2.6.1.64; 2.6.1.7;

The structure of Aedes Aegypti Kynurenine Aminotrasferase, PDB code: 1yiz was solved by Q.Han, Y.G.Gao, H.Robinson, H.Ding, S.Wilson, J.Li, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	10.00 / 1.55
Space group	P 21 21 21
Cell size a, b, c (Å), α, β, γ (°)	55.288, 94.984, 167.599, 90.00, 90.00, 90.00
R / Rfree (%)	n/a / n/a

The binding sites of Bromine atom in the Aedes Aegypti Kynurenine Aminotrasferase (pdb code 1yiz). This binding sites where shown within 5.0 Angstroms radius around Bromine atom.
In total 5 binding sites of Bromine where determined in the Aedes Aegypti Kynurenine Aminotrasferase, PDB code: 1yiz:
Jump to Bromine binding site number: 1; 2; 3; 4; 5;

Bromine binding site 1 out of 5 in the Aedes Aegypti Kynurenine Aminotrasferase


Mono view


Stereo pair view

A full contact list of Bromine with other atoms in the Br binding site number 1 of Aedes Aegypti Kynurenine Aminotrasferase within 5.0Å range: probe atom residue distance (Å) B Occ A:Br602 b:1.5 occ:1.00 N A:GLU230 2.9 23.5 1.0 CB A:GLU230 3.4 36.2 1.0 CA A:GLU230 3.6 37.3 1.0 OG A:SER318 3.7 34.1 1.0 CA A:PHE229 3.7 11.0 1.0 CB A:SER318 3.8 12.6 1.0 C A:PHE229 3.8 12.1 1.0 SD A:MET322 3.9 29.8 1.0 C A:SER318 4.1 7.9 1.0 O A:SER318 4.2 8.5 1.0 N A:GLY319 4.2 10.2 1.0 CB A:PHE229 4.2 9.7 1.0 CD1 A:PHE229 4.2 8.6 1.0 O A:HOH834 4.4 35.7 1.0 CG A:GLU230 4.4 45.2 1.0 CA A:GLY319 4.4 12.9 1.0 CB A:MET322 4.5 14.0 1.0 O A:VAL228 4.5 10.0 1.0 CA A:SER318 4.6 8.2 1.0 CG A:PHE229 4.8 12.3 1.0 CG A:MET322 4.9 26.8 1.0 N A:PHE229 4.9 11.9 1.0 O A:HOH648 4.9 14.1 1.0

Bromine binding site 2 out of 5 in the Aedes Aegypti Kynurenine Aminotrasferase


Mono view


Stereo pair view

A full contact list of Bromine with other atoms in the Br binding site number 2 of Aedes Aegypti Kynurenine Aminotrasferase within 5.0Å range: probe atom residue distance (Å) B Occ A:Br603 b:0.0 occ:1.00 O A:HOH833 3.3 21.3 1.0 N A:TYR54 3.7 10.9 1.0 CB A:LYS53 3.9 12.7 1.0 CD2 A:TYR54 3.9 16.1 1.0 N A:LYS53 4.0 10.7 1.0 CB A:TYR54 4.2 12.1 1.0 CA A:LYS53 4.3 11.2 1.0 C A:LYS53 4.4 11.0 1.0 CA A:TYR54 4.5 12.6 1.0 CG A:TYR54 4.6 15.3 1.0 C A:PRO52 4.8 11.5 1.0 CE2 A:TYR54 4.9 12.5 1.0

Bromine binding site 3 out of 5 in the Aedes Aegypti Kynurenine Aminotrasferase


Mono view


Stereo pair view

A full contact list of Bromine with other atoms in the Br binding site number 3 of Aedes Aegypti Kynurenine Aminotrasferase within 5.0Å range: probe atom residue distance (Å) B Occ A:Br605 b:9.8 occ:0.50 N A:HIS234 2.4 10.1 1.0 CG2 A:VAL228 2.8 22.9 1.0 O A:HOH751 3.0 11.7 1.0 CB A:HIS234 3.1 9.7 1.0 CA A:HIS234 3.3 10.9 1.0 C A:GLU233 3.4 12.1 1.0 CA A:GLU233 3.5 13.5 1.0 OE2 A:GLU233 3.6 52.8 1.0 CG1 A:VAL228 3.9 10.2 1.0 CB A:VAL228 3.9 11.7 1.0 O A:HIS234 4.0 13.7 1.0 CD A:GLU233 4.0 52.6 1.0 C A:HIS234 4.1 12.7 1.0 CB A:GLU233 4.2 17.4 1.0 CG A:GLU233 4.2 40.2 1.0 O A:HOH655 4.3 14.5 1.0 O A:GLU225 4.4 10.0 1.0 O A:GLU233 4.6 11.2 1.0 CG A:HIS234 4.6 7.1 1.0 N A:GLU233 4.6 10.1 1.0 O A:HOH669 4.7 16.6 1.0 O A:PHE232 4.7 11.7 1.0 OE1 A:GLU233 4.9 53.1 1.0

Bromine binding site 4 out of 5 in the Aedes Aegypti Kynurenine Aminotrasferase


Mono view


Stereo pair view

A full contact list of Bromine with other atoms in the Br binding site number 4 of Aedes Aegypti Kynurenine Aminotrasferase within 5.0Å range: probe atom residue distance (Å) B Occ B:Br601 b:0.0 occ:1.00 OG B:SER318 3.4 24.6 1.0 N B:GLU230 3.4 15.5 1.0 CA B:PHE229 3.9 12.9 1.0 O B:SER318 4.0 12.2 1.0 C B:SER318 4.0 11.8 1.0 N B:GLY319 4.1 12.3 1.0 CB B:SER318 4.1 14.2 1.0 C B:PHE229 4.2 16.9 1.0 CB B:GLU230 4.2 18.8 1.0 CD2 B:PHE229 4.2 13.1 1.0 CA B:GLY319 4.2 11.9 1.0 CG B:GLU230 4.2 22.0 1.0 SD B:MET322 4.3 31.6 1.0 CB B:PHE229 4.3 14.0 1.0 CB B:MET322 4.3 16.6 1.0 CA B:GLU230 4.4 20.3 1.0 CE B:MET322 4.5 22.6 1.0 O B:VAL228 4.6 12.7 1.0 CA B:SER318 4.7 12.3 1.0 CG B:PHE229 4.8 12.5 1.0 CG B:MET322 4.9 27.4 1.0 OE1 B:GLU230 5.0 50.3 1.0

Bromine binding site 5 out of 5 in the Aedes Aegypti Kynurenine Aminotrasferase


Mono view


Stereo pair view

A full contact list of Bromine with other atoms in the Br binding site number 5 of Aedes Aegypti Kynurenine Aminotrasferase within 5.0Å range: probe atom residue distance (Å) B Occ B:Br604 b:3.7 occ:1.00 N B:GLU245 3.2 15.8 1.0 CB B:GLU245 3.6 22.0 1.0 CB B:TRP244 3.8 13.2 1.0 N B:TRP244 3.8 14.5 1.0 CG B:GLU245 3.9 24.9 1.0 C B:GLY242 3.9 20.8 1.0 CA B:GLU245 4.0 15.1 1.0 CA B:GLY242 4.0 19.3 1.0 CA B:TRP244 4.0 15.4 1.0 C B:TRP244 4.1 19.2 1.0 O B:GLY242 4.1 21.9 1.0 N B:MET243 4.3 20.1 1.0 O B:HOH688 4.4 17.9 1.0 O B:PRO241 4.4 51.1 1.0 CD B:GLU245 4.5 31.6 1.0 C B:MET243 4.5 16.1 1.0 CG B:TRP244 4.6 15.1 1.0 CD1 B:TRP244 4.7 17.4 1.0 OE1 B:GLU245 4.8 33.4 1.0 NH2 B:ARG96 5.0 50.9 1.0

Q.Han, Y.G.Gao, H.Robinson, H.Ding, S.Wilson, J.Li. Crystal Structures of Aedes Aegypti Kynurenine Aminotransferase. Febs J. V. 272 2198 2005.
ISSN: ISSN 1742-464X
PubMed: 15853804
DOI: 10.1111/J.1742-4658.2005.04643.X