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MolNFT v1 · #50388 · protein

Crystal structure of LHX3 lim domains 1 and 2 with the binding domain of ISL1

2RGT · Fusion of LIM/HOMEOBOX protein LHX3, linker, insulin gene…: “Crystal structure of LHX3 lim domains 1 and 2 with the binding domain of ISL1”. X-ray diffraction, 1 ligand (ZN), 1 pocket (best druggability 0.39). MolNFT v1 #50388 on…

PDB
2RGT
Type
protein
Length
302 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Fusion of LIM/HOMEOBOX protein LHX3, linker, insulin gene enhancer protein isl-1
UniProt
P50481, P61372
Ligands
ZN
Pockets
1 · best druggability 0.39

Structure

x-ray diffraction · 2 distinct chains · 13% helix, 30% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AFusion of LIM/HOMEOBOX protein LHX3, linker, insulin gene enhancer protein isl-1protein14814% helix, 26% strandP50481, P61372
BFusion of LIM/HOMEOBOX protein LHX3, linker, insulin gene enhancer protein isl-1protein15412% helix, 33% strandP50481, P61372

Ligands and binding sites

  • ZN · Zinc ion · metal · 8 copies · chains A, B

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

Pockets

1 pocket found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11210.390.7422empty

Interfaces

1 interface between chains.

  • A–B · 283 Ų buried · 4 hydrogen bonds · protein-protein

Compared structures

  • 2RGT · Crystal Structure of Lhx3 LIM domains 1 and 2 with the binding domain of Isl1 · the same entry in another collection · chain A against A, TM-score 1.00
  • P61372 · AlphaFold monomer V2.0 prediction for insulin gene enhancer protein isl-1 (P61372) · a predicted model of the same protein · chain B against A, TM-score 0.87
  • P50481 · AlphaFold monomer V2.0 prediction for LIM/HOMEOBOX protein LHX3 (P50481) · a predicted model of the same protein · chain A against A, TM-score 0.71

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