MolNFT v1 · #91015 · protein

Crystal structure of type effector TSE1 C30A mutant from pseudomonas aeruginousa

4F0W · Putative uncharacterized protein: “Crystal structure of type effector TSE1 C30A mutant from pseudomonas aeruginousa”. X-ray diffraction, 1 pocket (best druggability 0.39). MolNFT v1 #91015 on GenesisL1: 3D structure, binding sites…

PDB: 4F0W
Type: protein
Length: 152 residues
Chains: 1
Method: x-ray diffraction
Collection: MolNFT v1 / PDB
Contract: 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner: 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule: Putative uncharacterized protein
UniProt: Q9I2Q1
Pockets: 1 · best druggability 0.39

Structure

x-ray diffraction · 1 distinct chain · 35% helix, 20% strand (DSSP).

Chain	Molecule	Type	Residues	Secondary structure	UniProt
A	Putative uncharacterized protein	protein	152	35% helix, 20% strand	Q9I2Q1

Ligands and binding sites

MLI · Malonate ion · additive · chains A
GOL · Glycerol · additive · 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.

Pocket	Volume (Å³)	Druggability	Buriedness	Lining residues	Inside
1	108	0.39	0.75	24	MLI, GOL

Modifications

Observed in the structure: 1 disulfide (disulfide).

Compared structures

4F0W · Crystal structure of type effector Tse1 C30A mutant from Pseudomonas aeruginousa · the same entry in another collection · chain A against A, TM-score 1.00
Q9I2Q1 · AlphaFold monomer V2.0 prediction for peptidoglycan amidase TSE1 (Q9I2Q1) · a predicted model of the same protein · chain A against A, TM-score 0.99

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 Q9I2Q1
Elsewhere: RCSB PDB 4F0W · PDBe 4F0W · UniProt Q9I2Q1

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