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Type I-F CRISPR-csy complex with its inhibitor ACRF6

Analyse Type I-F CRISPR-csy complex with its inhibitor ACRF6 in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6VQX
Type
protein + RNA
Length
3,032 residues
Chains
11
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
ACRF6; CRISPR-associated protein CSY1; Type I-F CRISPR-associated protein CSY2…
EC
3.1.-.-
UniProt
A0A5D4V3F2, Q02ML9, B3G161, A0A444M080, Q02MM2
Pockets
20 · best druggability 0.83

Structure

electron microscopy · 9 distinct chains · 25% helix, 19% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AACRF6protein9757% helix, 0% strandA0A5D4V3F2
BCRISPR-associated protein CSY1protein42236% helix, 9% strandQ02ML9
CType I-F CRISPR-associated protein CSY2protein30520% helix, 30% strandB3G161
DCRISPR-associated protein CSY3protein29324% helix, 24% strandA0A444M080
E, H, ICRISPR-associated protein CSY3protein33325% helix, 24% strandA0A444M080
FCRISPR-associated protein CSY3protein33425% helix, 23% strandA0A444M080
GCRISPR-associated protein CSY3protein33521% helix, 22% strandA0A444M080
JCRISPR-associated endonuclease CAS6/CSY4 (EC 3.1.-.-)protein1873% helix, 6% strandQ02MM2
KCrrna (60-mer)rna60——

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
19300.830.8494empty
210490.810.83105empty
31690.780.9429empty
410180.780.8082empty
511220.780.80122empty

Interfaces

30 interfaces between chains.

  • B–C · 4859 Ų buried · 70 hydrogen bonds · protein-protein
  • E–F · 2211 Ų buried · 30 hydrogen bonds · protein-protein
  • F–G · 2186 Ų buried · 30 hydrogen bonds · protein-protein
  • H–I · 2156 Ų buried · 20 hydrogen bonds · protein-protein
  • G–H · 2128 Ų buried · 28 hydrogen bonds · protein-protein

Compared structures

  • 6VQX · Type I-F CRISPR-Csy complex with its inhibitor AcrF6 · the same entry in another collection · chain K against K, TM-score 1.00
  • Q02MM2 · AlphaFold monomer V2.0 prediction for CRISPR-associated endonuclease CAS6/CSY4 (Q02MM2) · a predicted model of the same protein · chain J against A, TM-score 0.72

Analyse

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