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MolNFT v1 · #169590 · protein + RNA

Co-crystal structure of HIV-1 tar RNA in complex with lab-evolved rrm TBP6.7 mutant

6XH1 · Tar binding protein mutant 6.7 Q48R/T50R: “Co-crystal structure of HIV-1 tar RNA in complex with lab-evolved rrm TBP6.7 mutant”. X-ray diffraction, 2 pockets (best druggability 0.44). MolNFT v1 #169590 on GenesisL1: 3D structure…

PDB
6XH1
Type
protein + RNA
Length
113 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Tar binding protein mutant 6.7 Q48R/T50R; Trans-activation response element
Pockets
2 · best druggability 0.44

Structure

x-ray diffraction · 2 distinct chains · 29% helix, 26% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ATar binding protein mutant 6.7 Q48R/T50Rprotein8629% helix, 26% strand—
DTrans-activation response elementrna27——

Pockets

2 pockets found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11960.440.7420empty
2500.360.8014empty

Interfaces

1 interface between chains.

  • A–D · 812 Ų buried · 25 hydrogen bonds · protein-nucleic

Compared structures

  • 6XH1 · Co-crystal structure of HIV-1 TAR RNA in complex with lab-evolved RRM TBP6.7 mutant · the same entry in another collection · chain A against A, TM-score 1.00

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