MolNFT v1 · #94661 · protein
Crystal structure of fluorescent protein unag N57Q mutant
4I3C · Bilirubin-inducible fluorescent protein unag: “Crystal structure of fluorescent protein unag N57Q mutant”. X-ray diffraction, 1 ligand (BLR), 1 pocket (best druggability 0.89). MolNFT v1 #94661 on GenesisL1: 3D structure, binding…
- PDB
- 4I3C
- Type
- protein
- Length
- 278 residues
- Chains
- 2
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Bilirubin-inducible fluorescent protein unag
- UniProt
- P0DM59
- Ligands
- BLR
- Pockets
- 1 · best druggability 0.89
Structure
x-ray diffraction · 1 distinct chain · 13% helix, 51% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A, B | Bilirubin-inducible fluorescent protein unag | protein | 139 | 13% helix, 51% strand | P0DM59 |
Ligands and binding sites
- BLR · 3-[5-[(Z)-(4-ethenyl-3-methyl-5-oxidanylidene-pyrrol-2-ylidene)methyl]-2-[[5-[(Z)-(3-ethenyl-4-methyl-5-oxidanylidene-pyrrol-2-ylidene)methyl]-3-(3-hydroxy-3-oxopropyl)-4-methyl-1H-pyrrol-2-yl]methyl]-4-methyl-1H-pyrrol-3-yl]propanoic acid · ligand · 2 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, 1 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 1120 | 0.89 | 0.90 | 108 | BLR |
Interfaces
1 interface between chains.
- A–B · 606 Ų buried · 1 hydrogen bond · protein-protein
Compared structures
- 4I3C · Crystal structure of fluorescent protein UnaG N57Q mutant · the same entry in another collection · chain A against A, TM-score 1.00
- P0DM59 · AlphaFold monomer V2.0 prediction for bilirubin-inducible fluorescent protein unag… · a predicted model of the same protein · chain A against A, TM-score 0.93
Analyse
- Open in the research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides and crosslinks on the 3D structure
- Every structure of UniProt P0DM59
- Elsewhere: RCSB PDB 4I3C · PDBe 4I3C · UniProt P0DM59
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