MolNFT v1 · #63229 · protein

Crystal structure of leut bound to 4-fluoro-L-phenylalanine and sodium

3F3C · Transporter: “Crystal structure of leut bound to 4-fluoro-L-phenylalanine and sodium”. X-ray diffraction, 2 ligands (PFF, NA), 4 pockets (best druggability 0.71). MolNFT v1 #63229 on GenesisL1: 3D structure, binding sites and…

PDB: 3F3C
Type: protein
Length: 509 residues
Chains: 1
Method: x-ray diffraction
Collection: MolNFT v1 / PDB
Contract: 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner: 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule: Transporter
UniProt: O67854
Ligands: PFF, NA
Pockets: 4 · best druggability 0.71

Structure

x-ray diffraction · 1 distinct chain · 78% helix, 1% strand (DSSP).

Chain	Molecule	Type	Residues	Secondary structure	UniProt
A	Transporter	protein	509	78% helix, 1% strand	O67854

Ligands and binding sites

PFF · 4-fluoro-L-phenylalanine · ligand · chains A
NA · Sodium ion · metal · 2 copies · 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	645	0.71	0.78	53	empty
2	121	0.57	0.84	17	empty
3	73	0.40	0.78	14	empty
4	82	0.33	0.73	12	empty

Compared structures

3F3C · Crystal structure of LeuT bound to 4-Fluoro-L-Phenylalanine and sodium · 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 3F3C · PDBe 3F3C · UniProt O67854

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