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MolNFT v1 · #138425 · protein

Structure of the TRF1-TERB1 interface

5WIR · TERB1-tbm: “Structure of the TRF1-TERB1 interface”. X-ray diffraction, 6 pockets (best druggability 0.59). MolNFT v1 #138425 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
5WIR
Type
protein
Length
429 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
TERB1-tbm; Telomeric repeat-binding factor 1
UniProt
P54274
Pockets
6 · best druggability 0.59

Structure

x-ray diffraction · 3 distinct chains · 66% helix, 2% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
DTERB1-tbmprotein70% helix, 14% strand—
B, ATelomeric repeat-binding factor 1protein20572% helix, 0% strandP54274
CTERB1-tbmprotein120% helix, 17% strand—

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11420.590.8423empty
21040.550.8424empty
31060.390.7523empty
4850.350.7519empty
5610.330.7612empty

Interfaces

3 interfaces between chains.

  • B–A · 1344 Ų buried · 15 hydrogen bonds · protein-protein
  • C–A · 769 Ų buried · 16 hydrogen bonds · protein-protein
  • D–B · 579 Ų buried · 9 hydrogen bonds · protein-protein

Compared structures

  • 5WIR · Structure of the TRF1-TERB1 interface · the same entry in another collection · chain D against D, TM-score 1.00
  • P54274 · AlphaFold monomer V2.0 prediction for telomeric repeat-binding factor 1 (P54274) · a predicted model of the same protein · chain B against A, TM-score 0.95

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