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MolNFT v1 · #137996 · protein + RNA

Human IFIT1 dimer with ppp-aaaa

5W5I · Interferon-induced protein with tetratricopeptide repeats 1: “Human IFIT1 dimer with ppp-aaaa”. X-ray diffraction, 11 pockets (best druggability 0.73). MolNFT v1 #137996 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
5W5I
Type
protein + RNA
Length
874 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Interferon-induced protein with tetratricopeptide repeats 1; RNA…
UniProt
P09914
Pockets
11 · best druggability 0.73

Structure

x-ray diffraction · 3 distinct chains · 75% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AInterferon-induced protein with tetratricopeptide repeats 1protein43075% helix, 0% strandP09914
B, DRNA (5'-D(*(ATP))-R(P*AP*AP*A)-3')rna4——
CInterferon-induced protein with tetratricopeptide repeats 1protein43675% helix, 0% strandP09914

Pockets

11 pockets found on a 1 Å grid, 4 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1930.730.9626empty
21420.650.8832empty
32940.620.7937empty
42390.620.8129empty
51700.450.7420empty

Interfaces

3 interfaces between chains.

  • A–B · 985 Ų buried · 27 hydrogen bonds · protein-nucleic
  • C–D · 978 Ų buried · 28 hydrogen bonds · protein-nucleic
  • A–C · 549 Ų buried · 5 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 2 modified (nucleotide modification).

Compared structures

  • 5W5I · Human IFIT1 dimer with PPP-AAAA · the same entry in another collection · chain A against A, TM-score 1.00
  • P09914 · AlphaFold monomer V2.0 prediction for interferon-induced protein with tetratricopeptide… · a predicted model of the same protein · chain A against A, TM-score 0.99

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