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Crystal structure of RSU1/PINCH1_LIM45C complex

Analyse Crystal structure of RSU1/PINCH1_LIM45C complex in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7D2T
Type
protein
Length
753 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
RAS suppressor protein 1; Lim and senescent cell antigen-like-containing domain protein 1
UniProt
Q15404, P48059
Ligands
ZN
Pockets
9 · best druggability 0.78

Structure

x-ray diffraction · 3 distinct chains · 24% helix, 21% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, CRAS suppressor protein 1protein24731% helix, 11% strandQ15404
BLim and senescent cell antigen-like-containing domain protein 1protein13017% helix, 29% strandP48059
DLim and senescent cell antigen-like-containing domain protein 1protein12919% helix, 29% strandP48059

Ligands and binding sites

  • ZN · Zinc ion · metal · 8 copies · chains B, D
  • GOL · Glycerol · additive · 5 copies · chains A, B, C
  • TRS · 2-amino-2-hydroxymethyl-propane-1,3-diol · additive · 2 copies · chains A, C
  • PGE · Triethylene glycol · additive · 2 copies · chains B, D

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

Pockets

9 pockets found on a 1 Å grid, 4 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11130.780.9720empty
21860.720.8929empty
34720.690.8041empty
44470.670.7939empty
51340.450.7726empty

Interfaces

5 interfaces between chains.

  • A–B · 1235 Ų buried · 18 hydrogen bonds · protein-protein
  • C–D · 1167 Ų buried · 18 hydrogen bonds · protein-protein
  • B–D · 758 Ų buried · 8 hydrogen bonds · protein-protein
  • B–C · 505 Ų buried · 10 hydrogen bonds · protein-protein
  • A–D · 495 Ų buried · 11 hydrogen bonds · protein-protein

Compared structures

  • 7D2T · Crystal structure of Rsu1/PINCH1_LIM45C complex · the same entry in another collection · chain A against A, TM-score 1.00
  • Q15404 · AlphaFold monomer V2.0 prediction for RAS suppressor protein 1 (Q15404) · a predicted model of the same protein · chain A against A, TM-score 0.99
  • P48059 · AlphaFold monomer V2.0 prediction for lim and senescent cell antigen- like-containing… · a predicted model of the same protein · chain D against A, TM-score 0.78

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