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MolNFT v1 · #168154 · protein

Structure of ciap with compound 15

6W74 · Baculoviral iap repeat-containing protein 2: “Structure of ciap with compound 15”. X-ray diffraction, 2 ligands (TKY, ZN). MolNFT v1 #168154 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6W74
Type
protein
Length
87 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Baculoviral iap repeat-containing protein 2
EC
2.3.2.27
UniProt
Q13490
Ligands
TKY, ZN

Structure

x-ray diffraction · 1 distinct chain · 39% helix, 9% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ABaculoviral iap repeat-containing protein 2 (EC 2.3.2.27)protein8739% helix, 9% strandQ13490

Ligands and binding sites

  • TKY · 14-{[(3S)-2-(N-methyl-L-alanyl-3-methyl-L-valyl)-3-{[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]carbamoyl}-1, 2,3,4-tetrahydroisoquinolin-7-yl]oxy}-3,6,9,12-tetraoxatetradecan-1-yl (3R)-3-{5-amino-4-carbamoyl-3-[4-(2,4-difluorophenoxy)phenyl]-1H-pyrazol-1-yl}piperidine-1-carboxylate · ligand · chains A
  • ZN · Zinc ion · metal · chains A

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

Compared structures

  • 6W74 · Structure of cIAP with compound 15 · the same entry in another collection · chain A against A, TM-score 1.00
  • Q13490 · AlphaFold monomer V2.0 prediction for baculoviral iap repeat- containing protein 2… · a predicted model of the same protein · chain A against A, TM-score 0.96

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