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MolNFT v1 · #136135 · protein

Structure of the active form of human origin recognition complex and its ATPase motor module

5UJM · Origin recognition complex subunit 1: “Structure of the active form of human origin recognition complex and its ATPase motor module”. Electron microscopy, 2 ligands (ATP, MG), 20 pockets (best druggability 0.86). MolNFT v1 #136135…

PDB
5UJM
Type
protein
Length
1,928 residues
Chains
5
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Origin recognition complex subunit 1; Origin recognition complex subunit 2; Origin…
UniProt
Q13415, Q13416, Q9UBD5, O43929, O43913
Ligands
ATP, MG
Pockets
20 · best druggability 0.86

Structure

electron microscopy · 5 distinct chains · 55% helix, 9% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AOrigin recognition complex subunit 1protein33754% helix, 10% strandQ13415
BOrigin recognition complex subunit 2protein28747% helix, 13% strandQ13416
COrigin recognition complex subunit 3protein55362% helix, 5% strandQ9UBD5
DOrigin recognition complex subunit 4protein39455% helix, 9% strandO43929
EOrigin recognition complex subunit 5protein35750% helix, 10% strandO43913

Ligands and binding sites

  • ATP · Adenosine-5'-triphosphate · ligand · 3 copies · chains A, D, E
  • MG · Magnesium ion · metal · 2 copies · chains A, D, E

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

Pockets

20 pockets found on a 1 Å grid, 14 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
14750.860.9362empty
211050.810.82121empty
37000.800.8486empty
45750.800.8664ATP, MG
511480.790.8196ATP

Interfaces

7 interfaces between chains.

  • A–D · 2927 Ų buried · 41 hydrogen bonds · protein-protein
  • D–E · 2663 Ų buried · 32 hydrogen bonds · protein-protein
  • B–C · 1721 Ų buried · 14 hydrogen bonds · protein-protein
  • C–E · 1162 Ų buried · 12 hydrogen bonds · protein-protein
  • A–E · 487 Ų buried · 8 hydrogen bonds · protein-protein

Compared structures

  • 5UJM · Structure of the active form of human Origin Recognition Complex and its ATPase motor… · the same entry in another collection · chain E against E, TM-score 1.00
  • Q13415 · AlphaFold monomer V2.0 prediction for origin recognition complex subunit 1 (Q13415) · a predicted model of the same protein · chain A against A, TM-score 0.98
  • O43929 · AlphaFold monomer V2.0 prediction for origin recognition complex subunit 4 (O43929) · a predicted model of the same protein · chain D against A, TM-score 0.94
  • O43913 · AlphaFold monomer V2.0 prediction for origin recognition complex subunit 5 (O43913) · a predicted model of the same protein · chain E against A, TM-score 0.93
  • Q9UBD5 · AlphaFold monomer V2.0 prediction for origin recognition complex subunit 3 (Q9UBD5) · a predicted model of the same protein · chain C against A, TM-score 0.93
  • Q13416 · AlphaFold monomer V2.0 prediction for origin recognition complex subunit 2 (Q13416) · a predicted model of the same protein · chain B against A, TM-score 0.62

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