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Harnessing RIBOnucleic acid - Small molecules Structures

Illustration - complex

Complex 7d8c

Legend

Pocket colors by molecule type

 RNA

 Protein

 DNA

These colors appear when a pocket is selected (the structure fades to show the pocket surface). Colors from the molecule-type palette (RNA / protein / DNA).

System information

Experimental technique X-ray
Experimental resolution 3.60
System mass 143.41 kDa
Deposition year 2020
Molecule type RNA/Protein
# RNA entities 1
Organism N/A
RCSB PDB Entry 7d8c
Reference Zhang Bo, Luo Diyin, Li Yu, Perčulija Vanja, Chen Jing, Lin Jinying, Ye Yangmiao, Ouyang Songying. 2021. Mechanistic insights into the R-loop formation and cleavage in CRISPR-Cas12i1 Nature Communications
Equivalence Class NR_all_96851.1
BGSU version: 4.52

Pockets List

Legend

Cell colors for SiteScore and D Score:

 Favourable

 Intermediate

 Unfavourable

 Not available

ScoreThresholdMeaning
SiteScore< 0.8Non-drug binding site
SiteScore0.8 – 1.0Potential drug binding site
SiteScore> 1.0Promising binding site
D Score< 0.83Undruggable
D Score0.83 – 0.98Difficult
D Score> 0.98Druggable

Tick a pocket below to highlight it in the 3D structure above.

Compound CIT
Residue . / 1201
Chain D / A
Non-redundant False
Interacting RNA chains B/B
RNA environment detailled protein
RNA environment global RNA/Protein
RNA family chains B/B: unknown
RNA family global unknown
Volume 35.67 Å3
Hydrophobicity 0.035
Hydrophilicity 0.583
Buriedness 0.355
Don/acc character 0.775
SiteScore 0.698
D Score 0.757
Kd