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MolNFT v1 · #186093 · protein + DNA + RNA

Cryo-EM structure of human telomerase-DNA-TPP1-POT1 complex (with POT1 side chains)

7QXS · Telomerase reverse transcriptase: “Cryo-EM structure of human telomerase-DNA-TPP1-POT1 complex (with POT1 side chains)”. Electron microscopy, 20 pockets (best druggability 0.85). MolNFT v1 #186093 on GenesisL1: 3D structure, binding…

PDB
7QXS
Type
protein + DNA + RNA
Length
1,772 residues
Chains
7
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Telomerase reverse transcriptase; RNA (256-mer); Histone H2A; Histone H2B; Telomeric DNA…
EC
2.7.7.49
UniProt
O14746, B2R5B3, B4DR52, A0A590TQL1, Q9NUX5
Pockets
20 · best druggability 0.85

Structure

electron microscopy · 7 distinct chains · 42% helix, 19% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ATelomerase reverse transcriptase (EC 2.7.7.49)protein95146% helix, 13% strandO14746
BRNA (256-mer)rna256——
LHistone H2Aprotein8266% helix, 4% strandB2R5B3
MHistone H2Bprotein9077% helix, 3% strandB4DR52
NTelomeric DNAdna22——
OAdrenocortical dysplasia homolog (mouse), isoform CRA_Aprotein12023% helix, 38% strandA0A590TQL1
PProtection of telomeres protein 1protein25116% helix, 43% strandQ9NUX5

Pockets

20 pockets found on a 1 Å grid, 20 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
111170.850.86135empty
210240.830.8461empty
310040.810.8284empty
43240.780.8938empty
511460.760.7972empty

Interfaces

10 interfaces between chains.

  • A–B · 6435 Ų buried · 133 hydrogen bonds · protein-nucleic
  • L–M · 2526 Ų buried · 15 hydrogen bonds · protein-protein
  • A–N · 1743 Ų buried · 29 hydrogen bonds · protein-nucleic
  • A–O · 1099 Ų buried · 16 hydrogen bonds · protein-protein
  • N–P · 1080 Ų buried · 14 hydrogen bonds · protein-nucleic

Modifications

Observed in the structure: 1 disulfide (disulfide).

Compared structures

  • 7QXS · Cryo-EM structure of human telomerase-DNA-TPP1-POT1 complex (with POT1 side chains) · the same entry in another collection · chain P against P, TM-score 1.00
  • Q9NUX5 · AlphaFold monomer V2.0 prediction for protection of telomeres protein 1 (Q9NUX5) · a predicted model of the same protein · chain P against A, TM-score 0.99
  • O14746 · AlphaFold monomer V2.0 prediction for telomerase reverse transcriptase (O14746) · a predicted model of the same protein · chain A against A, TM-score 0.91

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