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MolNFT v1 · #114221 · protein

Crystal structure of PTLCIB4, a homolog of the limiting CO2-inducible protein lcib

5B5Y: “Crystal structure of PTLCIB4, a homolog of the limiting CO2-inducible protein lcib”. X-ray diffraction, 1 ligand (ZN), 5 pockets (best druggability 0.66). MolNFT v1 #114221 on GenesisL1: 3D structure, binding sites and pockets in…

PDB
5B5Y
Type
protein
Length
478 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
PTLCIB4
Ligands
ZN
Pockets
5 · best druggability 0.66

Structure

x-ray diffraction · 2 distinct chains · 45% helix, 21% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APTLCIB4protein23746% helix, 22% strand—
BPTLCIB4protein24145% helix, 21% strand—

Ligands and binding sites

  • ZN · Zinc ion · metal · 2 copies · chains A, B
  • ACT · Acetate ion · additive · 2 copies · chains A, B

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

Pockets

5 pockets found on a 1 Å grid, 3 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12150.660.8538empty
21940.540.7925empty
31270.510.8025empty
4630.390.8021ZN, ACT
5580.260.7413empty

Interfaces

1 interface between chains.

  • A–B · 2159 Ų buried · 41 hydrogen bonds · protein-protein

Compared structures

  • 5B5Y · Crystal structure of PtLCIB4, a homolog of the limiting CO2-inducible protein LCIB · the same entry in another collection · chain A against A, TM-score 1.00

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