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MolNFT v1 · #156095 · protein + RNA

Crystal structure of human RPP20-RPP25 proteins in complex with the P3 domain of lncrna rmrp

6LT7 · Ribonuclease P protein subunit P20: “Crystal structure of human RPP20-RPP25 proteins in complex with the P3 domain of lncrna rmrp”. X-ray diffraction, 7 pockets (best druggability 0.74). MolNFT v1 #156095 on GenesisL1: 3D structure…

PDB
6LT7
Type
protein + RNA
Length
578 residues
Chains
6
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Ribonuclease P protein subunit P20; Ribonuclease P protein subunit P25; 50-mer RNA
EC
3.1.26.5
UniProt
O75817, Q9BUL9
Pockets
7 · best druggability 0.74

Structure

x-ray diffraction · 4 distinct chains · 24% helix, 35% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, DRibonuclease P protein subunit P20 (EC 3.1.26.5)protein12422% helix, 35% strandO75817
BRibonuclease P protein subunit P25 (EC 3.1.26.5)protein11626% helix, 36% strandQ9BUL9
C, F50-mer RNArna49——
ERibonuclease P protein subunit P25 (EC 3.1.26.5)protein11626% helix, 34% strandQ9BUL9

Ligands and binding sites

  • EDO · 1,2-ethanediol · additive · 6 copies · chains A, B, E, F, C, D

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

Pockets

7 pockets found on a 1 Å grid, 5 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
110760.740.7783EDO
25630.730.8134empty
36010.720.8148empty
46750.680.7746empty
55820.640.7638empty

Interfaces

8 interfaces between chains.

  • A–C · 1788 Ų buried · 37 hydrogen bonds · protein-nucleic
  • D–F · 1706 Ų buried · 32 hydrogen bonds · protein-nucleic
  • B–C · 1094 Ų buried · 24 hydrogen bonds · protein-nucleic
  • E–F · 1045 Ų buried · 25 hydrogen bonds · protein-nucleic
  • D–E · 800 Ų buried · 16 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 8 modified (engineered).

Compared structures

  • 6LT7 · Crystal structure of human RPP20-RPP25 proteins in complex with the P3 domain of lncRNA… · the same entry in another collection · chain F against F, TM-score 1.00
  • Q9BUL9 · AlphaFold monomer V2.0 prediction for ribonuclease P protein subunit P25 (Q9BUL9) · a predicted model of the same protein · chain B against A, TM-score 0.96
  • O75817 · AlphaFold monomer V2.0 prediction for ribonuclease P protein subunit P20 (O75817) · a predicted model of the same protein · chain A against A, TM-score 0.86

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