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MolNFT v1 · #166860 · protein

K2P2.1(TREK-1)I110D:RUR:ML335 bound channel structure

6V37: “K2P2.1(TREK-1)I110D:RUR:ML335 bound channel structure”. X-ray diffraction, 5 ligands (D12, Q6F, R2R). MolNFT v1 #166860 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6V37
Type
protein
Length
534 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Ligands
D12, Q6F, R2R, K, CD

Structure

x-ray diffraction · 2 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein263——
B—protein271——

Ligands and binding sites

  • D12 · Dodecane · ligand · 4 copies · chains A, B
  • Q6F · N-[(2,4-dichlorophenyl)methyl]-4-[(methylsulfonyl) amino]benzamide · ligand · 2 copies · chains A, B
  • R2R · ruthenium(6+) azanide pentaamino(oxido)ruthenium (1/4/2) · ligand · chains A, B
  • K · Potassium ion · metal · 5 copies · chains A, B
  • CD · Cadmium ion · metal · 3 copies · chains A, B
  • HEX · Hexane · additive · chains B

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

Compared structures

  • 6V37 · K2P2.1(TREK-1)I110D:RuR:ML335 bound channel structure · the same entry in another collection · chain A against A, TM-score 1.00

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