Chlorine in PDB 7wlw: X-Ray Structure of Thermostabilized Drosophila Dopamine Transporter with Gaba TRANSPORTER1-Like Substitutions in the Binding Site, in Complex with SKF89976A

The structure of X-Ray Structure of Thermostabilized Drosophila Dopamine Transporter with Gaba TRANSPORTER1-Like Substitutions in the Binding Site, in Complex with SKF89976A, PDB code: 7wlw was solved by A.Penmatsa, D.Joseph, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	39.96 / 2.90
Space group	P 21 21 21
Cell size a, b, c (Å), α, β, γ (°)	96.78, 141.755, 168.236, 90, 90, 90
R / Rfree (%)	23.5 / 26.4

The structure of X-Ray Structure of Thermostabilized Drosophila Dopamine Transporter with Gaba TRANSPORTER1-Like Substitutions in the Binding Site, in Complex with SKF89976A also contains other interesting chemical elements:

Sodium

(Na)

2 atoms

The binding sites of Chlorine atom in the X-Ray Structure of Thermostabilized Drosophila Dopamine Transporter with Gaba TRANSPORTER1-Like Substitutions in the Binding Site, in Complex with SKF89976A (pdb code 7wlw). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total only one binding site of Chlorine was determined in the X-Ray Structure of Thermostabilized Drosophila Dopamine Transporter with Gaba TRANSPORTER1-Like Substitutions in the Binding Site, in Complex with SKF89976A, PDB code: 7wlw:

Chlorine binding site 1 out of 1 in the X-Ray Structure of Thermostabilized Drosophila Dopamine Transporter with Gaba TRANSPORTER1-Like Substitutions in the Binding Site, in Complex with SKF89976A


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of X-Ray Structure of Thermostabilized Drosophila Dopamine Transporter with Gaba TRANSPORTER1-Like Substitutions in the Binding Site, in Complex with SKF89976A within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl701 b:67.3 occ:1.00 OG A:SER320 3.0 60.7 1.0 OG A:SER356 3.1 65.5 1.0 OH A:TYR69 3.2 64.4 1.0 CB A:SER320 3.4 65.2 1.0 NE2 A:GLN316 3.5 72.8 1.0 CB A:SER356 3.8 62.7 1.0 CD1 A:PHE53 4.0 65.4 1.0 CZ A:TYR69 4.1 61.5 1.0 CE1 A:TYR69 4.2 59.7 1.0 CB A:PHE53 4.2 62.6 1.0 ND2 A:ASN49 4.2 62.1 1.0 CG A:PHE53 4.4 65.9 1.0 CG A:GLN316 4.4 63.6 1.0 CD A:GLN316 4.4 67.4 1.0 ND2 A:ASN352 4.7 71.6 1.0 CG A:ASN49 4.8 60.1 1.0 NA A:NA702 4.8 74.5 1.0 CE1 A:PHE53 4.8 60.2 1.0 CA A:SER320 4.9 70.8 1.0 OG A:SER353 4.9 74.2 1.0 O A:GLN316 4.9 65.4 1.0 CA A:ASN49 4.9 60.9 1.0 O A:ALA48 5.0 62.7 1.0

D.Joseph, S.R.Nayak, A.Penmatsa. Structural Insights Into Gaba Transport Inhibition Using An Engineered Neurotransmitter Transporter. Embo J. V. 41 10735 2022.
ISSN: ESSN 1460-2075
PubMed: 35796008
DOI: 10.15252/EMBJ.2022110735