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Atomic model of the ocr-bound methylase complex from the type I restriction-modification enzyme ecoki (M2S1). based on fitting into EM MAP 1534.

Analyse Atomic model of the ocr-bound methylase complex from the type I… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
2Y7C
Type
protein
Length
1,734 residues
Chains
5
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Type-1 restriction enzyme ecoki specificity protein; Type I restriction enzyme ecoki M…
EC
3.1.21.3, 2.1.1.72
UniProt
P05719, P08957, P03775
Pockets
20 · best druggability 0.79

Structure

electron microscopy · 3 distinct chains · 46% helix, 12% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AType-1 restriction enzyme ecoki specificity protein (EC 3.1.21.3)protein46444% helix, 15% strandP05719
B, CType I restriction enzyme ecoki M protein (EC 3.1.21.3, 2.1.1.72)protein52944% helix, 11% strandP08957
D, EGene 0.3 proteinprotein10667% helix, 0% strandP03775

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
18960.790.8296empty
28390.780.8186empty
3580.720.9918empty
46170.720.7967empty
53630.700.8344empty

Interfaces

10 interfaces between chains.

  • C–E · 742 Ų buried · 14 hydrogen bonds · protein-protein
  • B–D · 728 Ų buried · 10 hydrogen bonds · protein-protein
  • D–E · 538 Ų buried · 0 hydrogen bonds · protein-protein
  • A–E · 531 Ų buried · 3 hydrogen bonds · protein-protein
  • A–D · 511 Ų buried · 6 hydrogen bonds · protein-protein

Compared structures

  • 2Y7C · Atomic model of the Ocr-bound methylase complex from the Type I restriction-modification… · the same entry in another collection · chain B against B, TM-score 1.00
  • P08957 · AlphaFold monomer V2.0 prediction for type I restriction enzyme ecoki M protein (P08957) · a predicted model of the same protein · chain B against A, TM-score 0.83
  • P05719 · AlphaFold monomer V2.0 prediction for type-1 restriction enzyme ecoki specificity protein… · a predicted model of the same protein · chain A against A, TM-score 0.69

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