MolNFT v1 · #23941 · protein
Crystal structure of an artificial METALLOPROTEIN:FE(III)(3,3'-ME2- SALOPHEN)/APO-A71G myoglobin
1UFJ: “Crystal structure of an artificial METALLOPROTEIN:FE(III)(3,3'-ME2- SALOPHEN)/APO-A71G myoglobin”. X-ray diffraction, 3 ligands (CZM, FE, PO4), 1 pocket (best druggability 0.66). MolNFT v1 #23941 on GenesisL1: 3D structure, binding…
- PDB
- 1UFJ
- Type
- protein
- Length
- 154 residues
- Chains
- 1
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Myoglobin
- UniProt
- P02185
- Ligands
- CZM, FE, PO4
- Pockets
- 1 · best druggability 0.66
Structure
x-ray diffraction · 1 distinct chain · 77% helix, 0% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | Myoglobin | protein | 154 | 77% helix, 0% strand | P02185 |
Ligands and binding sites
- CZM · N,N'-bis-(2-hydroxy-3-methyl-benzylidene)-benzene-1,2-diamine · ligand · chains A
- FE · Fe (III) ion · metal · chains A
- PO4 · Phosphate ion · ion · 6 copies · chains A
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 | 205 | 0.66 | 0.84 | 26 | FE, CZM |
Compared structures
- 1UFJ · Crystal Structure of an Artificial Metalloprotein:Fe(III)(3,3'-Me2-salophen)/apo-A71G… · the same entry in another collection · chain A against A, TM-score 1.00
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 P02185
- Elsewhere: RCSB PDB 1UFJ · PDBe 1UFJ · UniProt P02185
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