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MolNFT v1 · #163938 · protein + RNA

Cryo-EM structure of the type III-B cmr-beta bound to cognate target RNA

6SIC · CRISPR-associated protein, CMR5 family: “Cryo-EM structure of the type III-B cmr-beta bound to cognate target RNA”. Electron microscopy, 1 ligand (ZN), 20 pockets (best druggability 0.89). MolNFT v1 #163938 on GenesisL1: 3D…

PDB
6SIC
Type
protein + RNA
Length
7,577 residues
Chains
35
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
CRISPR-associated protein, CMR5 family; CRISPR-associated ramp protein, CMR4 family…
UniProt
F0NDX5, F0NDX6, F0NDX1, F0NDX3, F0NDX4, F0NDX2, F0NDX7
Ligands
ZN
Pockets
20 · best druggability 0.89

Structure

electron microscopy · 10 distinct chains · 37% helix, 17% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ACRISPR-associated protein, CMR5 familyprotein15378% helix, 0% strandF0NDX5
B, CCRISPR-associated protein, CMR5 familyprotein15472% helix, 1% strandF0NDX5
D, E, F, GCRISPR-associated ramp protein, CMR4 familyprotein28525% helix, 32% strandF0NDX6
HCRISPR-associated protein, CMR3 familyprotein31223% helix, 27% strandF0NDX1
ICRISPR-associated ramp protein, CMR6 familyprotein28441% helix, 18% strandF0NDX3
JCRISPR-associated ramp protein, CMR1 familyprotein47534% helix, 20% strandF0NDX4
KCRISPR-associated protein, CMR2 familyprotein100938% helix, 10% strandF0NDX2
L, M, N, O, P, Q, R, S, T, W, l, m, n, o, p, q, r, s, t, w, X, xCRISPR-associated protein cmrxprotein17314% helix, 27% strandF0NDX7
UCognate target RNArna42——
VCrrnarna48——

Ligands and binding sites

  • ZN · Zinc ion · metal · chains K

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
111740.890.91146empty
28990.860.8793empty
311010.850.87121empty
411870.850.8686empty
56720.850.9047empty

Interfaces

101 interfaces between chains.

  • H–K · 2645 Ų buried · 35 hydrogen bonds · protein-protein
  • I–J · 2094 Ų buried · 21 hydrogen bonds · protein-protein
  • D–I · 1764 Ų buried · 10 hydrogen bonds · protein-protein
  • F–G · 1730 Ų buried · 16 hydrogen bonds · protein-protein
  • U–V · 1725 Ų buried · 166 hydrogen bonds · nucleic-nucleic

Modifications

Observed in the structure: 15 disulfide (disulfide).

Compared structures

  • 6SIC · Cryo-EM structure of the Type III-B Cmr-beta bound to cognate target RNA · the same entry in another collection · chain B against B, TM-score 1.00

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