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MolNFT v1 · #143821 · protein

Crystal structure of gltph R397C in complex with L-cysteine

6BAU · Glutamate transporter homolog: “Crystal structure of gltph R397C in complex with L-cysteine”. X-ray diffraction, 2 ligands (CYS, NA), 20 pockets (best druggability 0.88). MolNFT v1 #143821 on GenesisL1: 3D structure, binding sites…

PDB
6BAU
Type
protein
Length
1,224 residues
Chains
3
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Glutamate transporter homolog
UniProt
O59010
Ligands
CYS, NA
Pockets
20 · best druggability 0.88

Structure

x-ray diffraction · 1 distinct chain · 77% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, CGlutamate transporter homologprotein40877% helix, 0% strandO59010

Ligands and binding sites

  • CYS · Cysteine · ligand · 3 copies · chains A, B, C
  • NA · Sodium ion · metal · 6 copies · chains A, B, C

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

Pockets

20 pockets found on a 1 Å grid, 3 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
16440.880.9242empty
24590.590.7453empty
33430.530.7343empty
41610.430.7426empty
51090.400.7518empty

Interfaces

3 interfaces between chains.

  • A–C · 1125 Ų buried · 11 hydrogen bonds · protein-protein
  • B–C · 1123 Ų buried · 11 hydrogen bonds · protein-protein
  • A–B · 1114 Ų buried · 11 hydrogen bonds · protein-protein

Compared structures

  • 6BAU · Crystal Structure of GltPh R397C in complex with L-Cysteine · the same entry in another collection · chain B against B, TM-score 1.00
  • O59010 · AlphaFold monomer V2.0 prediction for glutamate transporter homolog (O59010) · a predicted model of the same protein · chain A against A, TM-score 0.96

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