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MolNFT v1 · #86857 · protein

Crystal structure RIF2 in complex with the C-terminal domain of RAP1 (RAP1-rct)

4BJ6 · RAP1-interacting factor 2: “Crystal structure RIF2 in complex with the C-terminal domain of RAP1 (RAP1-rct)”. X-ray diffraction, 1 ligand (SO4), 12 pockets (best druggability 0.72). MolNFT v1 #86857 on GenesisL1: 3D structure…

PDB
4BJ6
Type
protein
Length
911 residues
Chains
6
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
RAP1-interacting factor 2; DNA-binding protein RAP1
UniProt
Q06208, P11938
Ligands
SO4
Pockets
12 · best druggability 0.72

Structure

x-ray diffraction · 4 distinct chains · 52% helix, 10% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ARAP1-interacting factor 2protein29351% helix, 12% strandQ06208
BRAP1-interacting factor 2protein29050% helix, 12% strandQ06208
C, EDNA-binding protein RAP1protein15158% helix, 3% strandP11938
D, FRAP1-interacting factor 2protein1338% helix, 8% strandQ06208

Ligands and binding sites

  • SO4 · Sulfate ion · ion · 10 copies · chains A, B, C, E

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1560.720.9818empty
2550.720.9817empty
310390.700.7579empty
41690.520.7926empty
51920.520.7730empty

Interfaces

5 interfaces between chains.

  • B–C · 787 Ų buried · 7 hydrogen bonds · protein-protein
  • A–E · 759 Ų buried · 6 hydrogen bonds · protein-protein
  • E–F · 701 Ų buried · 2 hydrogen bonds · protein-protein
  • C–D · 681 Ų buried · 4 hydrogen bonds · protein-protein
  • A–B · 504 Ų buried · 1 hydrogen bond · protein-protein

Compared structures

  • 4BJ6 · Crystal structure Rif2 in complex with the C-terminal domain of Rap1 (Rap1-RCT) · the same entry in another collection · chain F against F, TM-score 1.00
  • Q06208 · AlphaFold monomer V2.0 prediction for protein RIF2 (Q06208) · a predicted model of the same protein · chain B against A, TM-score 0.99
  • P11938 · AlphaFold monomer V2.0 prediction for DNA-binding protein RAP1 (P11938) · a predicted model of the same protein · chain C against A, TM-score 0.97

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