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HARIBOSS

Harnessing RIBOnucleic acid - Small molecules Structures

Illustration - complex

Complex 1m1k

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 3.20
System mass 1458.90 kDa
Deposition year 2002
Molecule type RNA/Protein
# RNA entities 1
Organism Haloarcula
RCSB PDB Entry 1m1k
Reference Hansen Jeffrey L., Ippolito Joseph A., Ban Nenad, Nissen Poul, Moore Peter B., Steitz Thomas A.. 2002. The Structures of Four Macrolide Antibiotics Bound to the Large Ribosomal Subunit Molecular Cell
Equivalence Class NR_all_26150.5
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 ZIT
Residue . / 8600
Chain EA / A
Non-redundant True
Interacting RNA chains A/A
RNA environment detailled protein, ion
RNA environment global RNA/Protein
RNA family chains A/A: rRNA
RNA family global rRNA
Volume 587.90 Å3
Hydrophobicity 0.143
Hydrophilicity 1.649
Buriedness 0.727
Don/acc character 0.858
SiteScore 1.169
D Score 0.839
Kd