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MolNFT v1 · #160787 · protein

Structure of human mait a-F7 TCR in complex with human MR1-2`OH-ethyl- 5-op-U

6PUG: “Structure of human mait a-F7 TCR in complex with human MR1-2`OH-ethyl- 5-op-U”. X-ray diffraction, 3 ligands (OZD, NA, CL). MolNFT v1 #160787 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6PUG
Type
protein
Length
1,611 residues
Chains
8
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
Q95460, P61769
Ligands
OZD, NA, CL

Structure

x-ray diffraction · 8 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein264—Q95460
B—protein98—P61769
C—protein267—Q95460
D—protein196——
E—protein242——
F—protein100—P61769
G—protein200——
H—protein244——

Ligands and binding sites

  • OZD · 6-[(2-hydroxyethyl)amino]-5-[(E)-(2-oxopropylidene) amino]pyrimidine-2,4(1H,3H)-dione · ligand · 2 copies · chains A, G, C, D
  • NA · Sodium ion · metal · chains H
  • CL · Chloride ion · ion · chains E
  • GOL · Glycerol · additive · 3 copies · chains A, H, F

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

Compared structures

  • 6PUG · Structure of human MAIT A-F7 TCR in complex with human MR1-2`OH-Ethyl-5-OP-U · the same entry in another collection · chain H against H, TM-score 1.00
  • P61769 · AlphaFold monomer V2.0 prediction for beta-2-microglobulin (P61769) · a predicted model of the same protein · chain B against A, TM-score 0.98

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