Protein profile

PA3302

hypothetical protein

Genome: NC_002516.2

Gene: PA3302 Structure source: AlphaFold UniProt G3XD52
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Amino acids 156
Annotations 4
Features 13
PDB binders 8
Druggability 0.879

Overview

Basic information about this protein and its source genome.

Accession
PA3302
Assembly
Pseudomonas aeruginosa PAO1, complete genome
Gene
PA3302
Status
annotated
Amino acids
156
Structure source
AlphaFold
GO
GO:0005835 A multienzyme complex that catalyses the synthesis of fatty acids from acetyl CoA. GO:0019171 Catalysis of the reaction: a (3R)-hydroxyacyl-[acyl-carrier-protein] = a (2E)-enoyl-[acyl-carrier-protein] + H2O. GO:0004312 Catalysis of the reaction: acetyl-CoA + n malonyl-CoA + 2n NADPH + 2n H+ = long-chain fatty acid + n+1 CoA + n CO2 + 2n NADP+. GO:0006633 The chemical reactions and pathways resulting in the formation of a fatty acid, any of the aliphatic monocarboxylic acids that can be liberated by hydrolysis from naturally occurring fats and oils. Fatty acids are predominantly straight-chain acids of 4 to 24 carbon atoms, which may be saturated or unsaturated; branched fatty acids and hydroxy fatty acids also occur, and very long chain acids of over 30 carbons are found in waxes.

Target profile

Computed evidence for target prioritization.

Human off-target
hit
Human identity (%)
32.609
Human E-value
1.23e-22
Gut microbiome off-target
hit
Essential (DEG)
N
Localization
Unknown

Selected Druggability evidence

Selected Druggability is the FPocket score chosen for ranking using the curated structure priority. The 3D viewer may show a different loaded structure, so its visible pockets can differ.

FPocket 0.879
Structure –
Pocket –

Sequence

Primary amino-acid sequence viewer.

Functional Annotations

Enzyme classification and Gene Ontology terms linked to this protein.

4 GO

Gene Ontology (GO)

4
  • GO:0005835 A multienzyme complex that catalyses the synthesis of fatty acids from acetyl CoA.
  • GO:0019171 Catalysis of the reaction: a (3R)-hydroxyacyl-[acyl-carrier-protein] = a (2E)-enoyl-[acyl-carrier-protein] + H2O.
  • GO:0004312 Catalysis of the reaction: acetyl-CoA + n malonyl-CoA + 2n NADPH + 2n H+ = long-chain fatty acid + n+1 CoA + n CO2 + 2n NADP+.
  • GO:0006633 The chemical reactions and pathways resulting in the formation of a fatty acid, any of the aliphatic monocarboxylic acids that can be liberated by hydrolysis from naturally occurring fats and oils. Fatty acids are predominantly straight-chain acids of 4 to 24 carbon atoms, which may be saturated or unsaturated; branched fatty acids and hydroxy fatty acids also occur, and very long chain acids of over 30 carbons are found in waxes.

Sequence Features

Domain/signature hits from InterPro and related databases.

13 records
Show feature table
Start End DB Term Name
16 116 Pfam PF01575 MaoC like domain
16 116 InterPro IPR002539 MaoC-like dehydratase domain
12 138 CDD cd03449 R_hydratase
63 85 TMHMM TMhelix Region of a membrane-bound protein predicted to be embedded in the membrane.
26 48 PRINTS PR01483 Fatty acid synthase signature
26 48 InterPro IPR003965 Fatty acid synthase
48 69 PRINTS PR01483 Fatty acid synthase signature
48 69 InterPro IPR003965 Fatty acid synthase
12 141 PANTHER PTHR43437 HYDROXYACYL-THIOESTER DEHYDRATASE TYPE 2, MITOCHONDRIAL-RELATED
2 156 Gene3D G3DSA:3.10.129.10 Hotdog Thioesterase
4 144 FunFam G3DSA:3.10.129.10:FF:000042 MaoC domain protein dehydratase
5 141 SUPERFAMILY SSF54637 Thioesterase/thiol ester dehydrase-isomerase
5 141 InterPro IPR029069 HotDog domain superfamily

3D Structure

Selected loaded structure. Experimental PDB entries may cover only a portion of the sequence; predicted models typically cover the full protein.

3D visualization script Full viewer

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Structural evidence

0 + 1

Experimental PDB entries and predicted models. Click Switch to display a different structure in the viewer.

Entry Method Resolution Chain Coverage Links Status
AlphaFold PA3302
AlphaFold — — full sequence — Viewing
Pocket details FPocket · P2Rank — toggle visibility and zoom from here, or open full viewer

Pockets (FPOCKET)

Showing top-ranked FPocket candidates by druggability. Druggability is color-coded: high (0.7 or higher), medium (0.4 to 0.69), low (below 0.4).

FPOCKET Sticks Spheres Surfaces Druggability Labels Zoom Positions
3 0.879
1 0.751

Ligand evidence

Ligands grouped by evidence source. PDB ligands keep the source crystal visible, and loaded crystals can be opened directly in the structure viewer.

58 records

Structural evidence inferred from similar proteins. The source crystal indicates where the ligand was observed; the UniProt column identifies the homologous protein carrying that ligand.

Show only:
Ligand Source crystal UniProt (homolog) MW · LogP · TPSA Lipinski PAINS SMILES
BTB
4V12
A0R724 209.2 Da LogP -3.01 TPSA 104.4 ✓ Ro5 ✓ Clean C(CO)N(CCO)C(CO)(CO)CO
BUN
4RLW
I6WYY7 272.3 Da LogP 2.41 TPSA 98.0 ✓ Ro5 Alert c1cc(c(cc1/C=C/C(=O)c2ccc(cc2O)O)O)O
CO8
6JQN
P77455 893.7 Da LogP 1.03 TPSA 363.6 3 viol. ✓ Clean CCCCCCCC(=O)SCCNC(=O)CCNC(=O)[C@@H](C(C)(C)CO[P…
COO
6JQO
P77455 835.6 Da LogP -0.76 TPSA 363.6 3 viol. ✓ Clean CC=CC(=O)SCCNC(=O)CCNC(=O)[C@H](C(C)(C)CO[P@@](…
FSE
4RLT
I6WYY7 286.2 Da LogP 2.28 TPSA 111.1 ✓ Ro5 Alert c1cc(c(cc1C2=C(C(=O)c3ccc(cc3O2)O)O)O)O
HCC
4RLU
I6WYY7 256.3 Da LogP 2.70 TPSA 77.8 ✓ Ro5 ✓ Clean c1cc(ccc1C=CC(=O)c2ccc(cc2O)O)O
P33
4RLJ
I6WYY7 326.4 Da LogP -0.93 TPSA 95.8 ✓ Ro5 ✓ Clean C(COCCOCCOCCOCCOCCOCCO)O
POG
4V12
A0R724 424.6 Da LogP 1.79 TPSA 95.8 ✓ Ro5 ✓ Clean C[C@H](CO)OC[C@@H](C)OC[C@@H](C)OC[C@@H](C)OC[C…

PDB and ChEMBL records on this protein are shown in full. ChEMBL records from similar proteins are capped at the top 100 per protein (by pchembl) and ZINC at the top 50 (Tanimoto ≥ 0.5). ADME columns are descriptor-based screening flags, not experimental toxicity results.