MolNFT v1 · #30671 · protein

Crystal structure of leutaa, a bacterial homolog of NA+/CL--dependent neurotransmitter transporters

2A65 · NA(+):NEUROTRANSMITTER symporter (snf family): “Crystal structure of leutaa, a bacterial homolog of NA+/CL--dependent neurotransmitter transporters”. X-ray diffraction, 3 ligands (LEU, NA, CL), 4 pockets (best druggability 0.71).…

PDB: 2A65
Type: protein
Length: 509 residues
Chains: 1
Method: x-ray diffraction
Collection: MolNFT v1 / PDB
Contract: 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner: 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule: NA(+):NEUROTRANSMITTER symporter (snf family)
UniProt: O67854
Ligands: LEU, NA, CL
Pockets: 4 · best druggability 0.71

Structure

x-ray diffraction · 1 distinct chain · 77% helix, 1% strand (DSSP).

Chain	Molecule	Type	Residues	Secondary structure	UniProt
A	NA(+):NEUROTRANSMITTER symporter (snf family)	protein	509	77% helix, 1% strand	O67854

Ligands and binding sites

LEU · Leucine · ligand · chains A
NA · Sodium ion · metal · 2 copies · chains A
CL · Chloride ion · ion · chains A
BOG · octyl beta-D-glucopyranoside · additive · 5 copies · chains A

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Pockets

4 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.

Pocket	Volume (Å³)	Druggability	Buriedness	Lining residues	Inside
1	604	0.71	0.79	52	empty
2	98	0.57	0.86	18	empty
3	77	0.43	0.79	13	empty
4	93	0.36	0.74	12	empty

Compared structures

2A65 · Crystal structure of LEUTAA, a bacterial homolog of Na+/Cl--dependent neurotransmitter… · the same entry in another collection · chain A against A, TM-score 1.00

Analyse

Open in the research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides and crosslinks on the 3D structure
Every structure of UniProt O67854
Elsewhere: RCSB PDB 2A65 · PDBe 2A65 · UniProt O67854

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