MolNFT v1 · #45797 · protein
Structure of ecdsba-SULFONAMIDE1 complex
2NDO · THIOL:DISULFIDE interchange protein dsba: “Structure of ecdsba-SULFONAMIDE1 complex”. Solution nmr, 1 ligand (SFQ), 1 pocket (best druggability 0.44). MolNFT v1 #45797 on GenesisL1: 3D structure, binding sites and pockets in GL1X.
- PDB
- 2NDO
- Type
- protein
- Length
- 189 residues
- Chains
- 1
- Method
- solution nmr
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- THIOL:DISULFIDE interchange protein dsba
- UniProt
- P0AEG4
- Ligands
- SFQ
- Pockets
- 1 · best druggability 0.44
Structure
solution nmr · 1 distinct chain · 53% helix, 11% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | THIOL:DISULFIDE interchange protein dsba | protein | 189 | 53% helix, 11% strand | P0AEG4 |
Ligands and binding sites
- SFQ · 2-{[(4-iodophenyl)sulfonyl]amino}benzoic acid · ligand · 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, 0 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 112 | 0.44 | 0.78 | 20 | empty |
Compared structures
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 P0AEG4
- Elsewhere: RCSB PDB 2NDO · PDBe 2NDO · UniProt P0AEG4
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