Bromine in PDB 9j6i: Crystal Structure of the Aba Receptor PYL1 in Complex with Dbsa Compound

The structure of Crystal Structure of the Aba Receptor PYL1 in Complex with Dbsa Compound, PDB code: 9j6i was solved by J.Yan, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	43.68 / 2.30
Space group	P 65
Cell size a, b, c (Å), α, β, γ (°)	126.99, 126.99, 60.195, 90, 90, 120
R / Rfree (%)	20.7 / 25.2

The binding sites of Bromine atom in the Crystal Structure of the Aba Receptor PYL1 in Complex with Dbsa Compound (pdb code 9j6i). This binding sites where shown within 5.0 Angstroms radius around Bromine atom.
In total 2 binding sites of Bromine where determined in the Crystal Structure of the Aba Receptor PYL1 in Complex with Dbsa Compound, PDB code: 9j6i:
Jump to Bromine binding site number: 1; 2;

Bromine binding site 1 out of 2 in the Crystal Structure of the Aba Receptor PYL1 in Complex with Dbsa Compound


Mono view


Stereo pair view

A full contact list of Bromine with other atoms in the Br binding site number 1 of Crystal Structure of the Aba Receptor PYL1 in Complex with Dbsa Compound within 5.0Å range: probe atom residue distance (Å) B Occ B:Br201 b:76.0 occ:1.00 BR1 B:H9X201 0.0 76.0 1.0 C1 B:H9X201 1.9 86.7 1.0 C2 B:H9X201 2.9 87.9 1.0 C6 B:H9X201 2.9 91.0 1.0 OH B:TYR126 3.2 52.2 1.0 CD1 B:ILE173 3.5 48.3 1.0 CZ B:TYR126 3.6 48.4 1.0 CG1 B:ILE173 3.7 43.9 1.0 CE2 B:TYR126 3.7 48.9 1.0 O B:ALA169 3.8 53.0 1.0 CA B:ALA169 3.9 52.8 1.0 CG1 B:VAL172 3.9 57.7 1.0 CB B:ALA169 4.0 55.5 1.0 CB B:VAL172 4.1 57.6 1.0 C3 B:H9X201 4.2 83.0 1.0 C5 B:H9X201 4.2 86.0 1.0 C B:ALA169 4.3 48.1 1.0 CE1 B:TYR126 4.7 45.4 1.0 N B:ILE173 4.7 48.9 1.0 C4 B:H9X201 4.7 80.5 1.0 CD2 B:TYR126 4.8 49.2 1.0 O B:HOH303 4.8 52.6 1.0 CB B:ILE173 4.9 52.4 1.0 CG2 B:VAL172 5.0 61.8 1.0

Bromine binding site 2 out of 2 in the Crystal Structure of the Aba Receptor PYL1 in Complex with Dbsa Compound


Mono view


Stereo pair view

A full contact list of Bromine with other atoms in the Br binding site number 2 of Crystal Structure of the Aba Receptor PYL1 in Complex with Dbsa Compound within 5.0Å range: probe atom residue distance (Å) B Occ B:Br201 b:93.3 occ:1.00 BR2 B:H9X201 0.0 93.3 1.0 C10 B:H9X201 1.9 86.0 1.0 C11 B:H9X201 2.8 79.1 1.0 C9 B:H9X201 2.9 78.7 1.0 O A:SER91 3.6 79.5 1.0 CD1 B:PHE67 3.6 59.5 1.0 CE1 B:PHE67 3.6 57.8 1.0 O B:ILE90 3.8 54.1 1.0 CG B:PHE67 4.1 57.1 1.0 CZ B:PHE67 4.1 52.6 1.0 C12 B:H9X201 4.1 69.6 1.0 C8 B:H9X201 4.2 76.6 1.0 CE1 A:PHE168 4.4 46.3 1.0 CE1 B:PHE168 4.4 57.1 1.0 CD2 B:PHE67 4.5 54.9 1.0 CE2 B:PHE67 4.5 53.9 1.0 CA B:SER91 4.5 50.2 1.0 C A:SER91 4.7 69.6 1.0 C7 B:H9X201 4.7 72.9 1.0 CZ B:PHE168 4.7 63.5 1.0 CB B:PHE67 4.8 51.9 1.0 CB A:SER91 4.8 55.5 1.0 C B:ILE90 4.8 55.6 1.0

J.Yan, J.Yan. N/A N/A.