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Cryo-EM structure of deptor bound to human mtor complex 1, dept-bound subset local refinement

Analyse Cryo-EM structure of deptor bound to human mtor complex 1, dept-bound subset… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7PEC
Type
protein
Length
3,878 residues
Chains
4
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
SERINE/THREONINE-protein kinase mtor; Target of rapamycin complex subunit LST8…
EC
2.7.11.1
UniProt
P42345, Q9BVC4, Q8N122, Q8TB45
Ligands
IHP
Pockets
20 · best druggability 0.81

Structure

electron microscopy · 4 distinct chains · 56% helix, 11% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ASERINE/THREONINE-protein kinase mtor (EC 2.7.11.1)protein219274% helix, 2% strandP42345
CTarget of rapamycin complex subunit LST8protein3170% helix, 43% strandQ9BVC4
ERegulatory-associated protein of mtorprotein105241% helix, 16% strandQ8N122
IDep domain-containing mtor-interacting proteinprotein31737% helix, 21% strandQ8TB45

Ligands and binding sites

  • IHP · Inositol hexakisphosphate · ligand · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
110980.810.8374empty
28130.810.8461empty
310360.790.8085empty
49860.780.8084empty
54450.750.8453empty

Interfaces

3 interfaces between chains.

  • A–I · 2320 Ų buried · 27 hydrogen bonds · protein-protein
  • A–C · 943 Ų buried · 9 hydrogen bonds · protein-protein
  • A–E · 769 Ų buried · 9 hydrogen bonds · protein-protein

Compared structures

  • 7PEC · cryo-EM structure of DEPTOR bound to human mTOR complex 1, DEPt-bound subset local… · the same entry in another collection · chain I against I, TM-score 1.00
  • Q8N122 · AlphaFold monomer V2.0 prediction for regulatory-associated protein of mtor (Q8N122) · a predicted model of the same protein · chain E against A, TM-score 0.99
  • Q9BVC4 · AlphaFold monomer V2.0 prediction for target of rapamycin complex subunit LST8 (Q9BVC4) · a predicted model of the same protein · chain C against A, TM-score 0.97
  • P42345 · AlphaFold monomer V2.0 prediction for SERINE/THREONINE-protein kinase mtor (P42345) · a predicted model of the same protein · chain A against A, TM-score 0.87
  • Q8TB45 · AlphaFold monomer V2.0 prediction for dep domain-containing mtor- interacting protein… · a predicted model of the same protein · chain I against A, TM-score 0.63

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