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MolNFT v1 · #189033 · protein + RNA

Staphylococcus epidermidis RP62A CRISPR effector subcomplex with non- self target RNA bound

7UZX · CRISPR system cms endoribonuclease CSM3: “Staphylococcus epidermidis RP62A CRISPR effector subcomplex with non- self target RNA bound”. Electron microscopy, 20 pockets (best druggability 0.81). MolNFT v1 #189033 on GenesisL1: 3D…

PDB
7UZX
Type
protein + RNA
Length
1,796 residues
Chains
9
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
CRISPR system cms endoribonuclease CSM3; CRISPR system cms protein CSM4; CRISPR system…
UniProt
Q5HK91, Q5HK92, Q5HK89
Pockets
20 · best druggability 0.81

Structure

electron microscopy · 7 distinct chains · 36% helix, 21% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, C, DCRISPR system cms endoribonuclease CSM3protein20426% helix, 33% strandQ5HK91
BCRISPR system cms endoribonuclease CSM3protein19326% helix, 32% strandQ5HK91
ECRISPR system cms endoribonuclease CSM3protein18429% helix, 24% strandQ5HK91
HCRISPR system cms protein CSM4protein29324% helix, 23% strandQ5HK92
FCRISPR system single-strand-specific deoxyribonuclease CAS10/CSM1 (subtype III-a)protein47853% helix, 10% strandQ5HK89
GStaphylococcus epidermidis RP62A CRISPR RNA: repeat plus spacer sequence 2rna31——
LCRISPR non-self RNA targetrna5——

Pockets

20 pockets found on a 1 Å grid, 18 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
18030.810.8463empty
27370.770.8292empty
3660.740.9719empty
43840.720.8337empty
54080.700.8248empty

Interfaces

21 interfaces between chains.

  • H–G · 1566 Ų buried · 23 hydrogen bonds · protein-nucleic
  • D–E · 1464 Ų buried · 16 hydrogen bonds · protein-protein
  • C–D · 1374 Ų buried · 10 hydrogen bonds · protein-protein
  • A–C · 1367 Ų buried · 13 hydrogen bonds · protein-protein
  • A–B · 1332 Ų buried · 11 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 1 disulfide (disulfide).

Compared structures

  • 7UZX · Staphylococcus epidermidis RP62a CRISPR effector subcomplex with non-self target RNA bound · the same entry in another collection · chain A against A, TM-score 1.00

Analyse

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