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MolNFT v1 · #109899 · protein

Crystal structure of the eukaryotic origin recognition complex

4XGC · Origin recognition complex subunit 2: “Crystal structure of the eukaryotic origin recognition complex”. X-ray diffraction, 2 ligands (K, CL), 20 pockets (best druggability 0.85). MolNFT v1 #109899 on GenesisL1: 3D structure, binding…

PDB
4XGC
Type
protein
Length
2,056 residues
Chains
7
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Origin recognition complex subunit 2; Origin recognition complex subunit 3; Origin…
EC
3.6.1.15
UniProt
Q24168, Q7K2L1, Q24169, O16810, Q9Y1B2, Q9W102
Ligands
K, CL
Pockets
20 · best druggability 0.85

Structure

x-ray diffraction · 7 distinct chains · 58% helix, 9% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
BOrigin recognition complex subunit 2protein28151% helix, 11% strandQ24168
COrigin recognition complex subunit 3protein56766% helix, 8% strandQ7K2L1
EOrigin recognition complex subunit 5protein40251% helix, 11% strandQ24169
AOrigin recognition complex subunit 1protein31060% helix, 11% strandO16810
GOrigin recognition complex subunit 2protein3735% helix, 0% strand—
FOrigin recognition complex subunit 6protein1984% helix, 0% strandQ9Y1B2
DOrigin recognition complex subunit 4 (EC 3.6.1.15)protein44056% helix, 9% strandQ9W102

Ligands and binding sites

  • K · Potassium ion · metal · chains B
  • CL · Chloride ion · ion · chains 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, 15 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
18670.850.8787empty
27920.810.84105K
31350.800.9727empty
49930.770.7985empty
54400.770.8665CL

Interfaces

15 interfaces between chains.

  • E–D · 2932 Ų buried · 31 hydrogen bonds · protein-protein
  • B–C · 2100 Ų buried · 20 hydrogen bonds · protein-protein
  • C–E · 1955 Ų buried · 11 hydrogen bonds · protein-protein
  • A–D · 1306 Ų buried · 13 hydrogen bonds · protein-protein
  • B–E · 838 Ų buried · 6 hydrogen bonds · protein-protein

Compared structures

  • 4XGC · Crystal structure of the eukaryotic origin recognition complex · the same entry in another collection · chain D against D, TM-score 1.00
  • Q24168 · AlphaFold monomer V2.0 prediction for origin recognition complex subunit 2 (Q24168) · a predicted model of the same protein · chain B against A, TM-score 0.98
  • Q24169 · AlphaFold monomer V2.0 prediction for origin recognition complex subunit 5 (Q24169) · a predicted model of the same protein · chain E against A, TM-score 0.94
  • Q9Y1B2 · AlphaFold monomer V2.0 prediction for origin recognition complex subunit 6 (Q9Y1B2) · a predicted model of the same protein · chain F against A, TM-score 0.75
  • O16810 · AlphaFold monomer V2.0 prediction for origin recognition complex subunit 1 (O16810) · a predicted model of the same protein · chain A against A, TM-score 0.62

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