Protein profile
KP13_03808
Capsule polysaccharide export protein in cps region
Genome: KpKP13
Overview
Basic information about this protein and its source genome.
- Accession
- KP13_03808
- Gene
- wza AHE43655.1
- Status
- annotated
- Amino acids
- 377
- Structure source
- AlphaFold + ColabFold
Target profile
Computed evidence for target prioritization.
- Human off-target
- No hit
- Human identity (%)
- 0.0
- Gut microbiome off-target
- hit
- Essential (DEG)
- Y
- DEG identity (%)
- 41.197
- DEG E-value
- 6.469999999999999e-61
- Localization
- OuterMembrane
- ColabFold pLDDT
- 92.8
Selected Druggability evidence
AlphaFold / UniProt modelSelected 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.
Sequence
Primary amino-acid sequence viewer.
Functional Annotations
Enzyme classification and Gene Ontology terms linked to this protein.
Gene Ontology (GO)
7- GO:0015774 The directed movement of polysaccharides into, out of or within a cell, or between cells, by means of some agent such as a transporter or pore. A polysaccharide is a polymer of many (typically more than 10) monosaccharide residues linked glycosidically.
- GO:0015159 Enables the transfer of polysaccharides from one side of a membrane to the other. A polysaccharide is a polymer of many (typically more than 10) monosaccharide residues linked glycosidically.
- GO:0016020 A lipid bilayer along with all the proteins and protein complexes embedded in it and attached to it.
- GO:0009279 A lipid bilayer that forms the outermost membrane of the cell envelope; enriched in polysaccharide and protein; the outer leaflet of the membrane contains specific lipopolysaccharide structures.
- GO:0046930 A protein complex providing a discrete opening in a membrane that allows the passage of gases and/or liquids.
- GO:0015288 Enables the transfer of substances, sized less than 1000 Da, from one side of a membrane to the other. The transmembrane portions of porins consist exclusively of beta-strands which form a beta-barrel. They are found in the outer membranes of Gram-negative bacteria, mitochondria, plastids and possibly acid-fast Gram-positive bacteria.
- GO:0006811 The directed movement of a monoatomic ion into, out of or within a cell, or between cells, by means of some agent such as a transporter or pore. Monatomic ions (also called simple ions) are ions consisting of exactly one atom.
Sequence Features
Domain/signature hits from InterPro and related databases.
Show feature table
| Start | End | DB | Term | Name |
|---|---|---|---|---|
| 5 | 27 | TMHMM | TMhelix | Region of a membrane-bound protein predicted to be embedded in the membrane. |
| 73 | 368 | PANTHER | PTHR33619 | POLYSACCHARIDE EXPORT PROTEIN GFCE-RELATED |
| 8 | 18 | Phobius | SIGNAL_PEPTIDE_H_REGION | Hydrophobic region of a signal peptide. |
| 1 | 7 | Phobius | SIGNAL_PEPTIDE_N_REGION | N-terminal region of a signal peptide. |
| 173 | 222 | Pfam | PF10531 | SLBB domain |
| 173 | 222 | InterPro | IPR019554 | Soluble ligand binding domain |
| 256 | 309 | Pfam | PF10531 | SLBB domain |
| 256 | 309 | InterPro | IPR019554 | Soluble ligand binding domain |
| 345 | 374 | Pfam | PF18412 | Outer-membrane lipoprotein Wza C-terminal domain |
| 345 | 374 | InterPro | IPR040716 | Outer-membrane lipoprotein Wza, C-terminal domain |
| 345 | 376 | Gene3D | G3DSA:1.20.5.70 | - |
| 1 | 23 | Phobius | SIGNAL_PEPTIDE | Signal peptide region |
| 175 | 252 | Gene3D | G3DSA:3.10.560.10 | Outer membrane lipoprotein wza domain like |
| 89 | 169 | Gene3D | G3DSA:3.30.1950.10 | wza like domain |
| 24 | 377 | Phobius | NON_CYTOPLASMIC_DOMAIN | Region of a membrane-bound protein predicted to be outside the membrane, in the extracellular region. |
| 255 | 342 | Gene3D | G3DSA:3.10.560.10 | Outer membrane lipoprotein wza domain like |
| 1 | 13 | SignalP_GRAM_POSITIVE | SignalP-TM | SignalP-TM |
| 1 | 21 | ProSiteProfiles | PS51257 | Prokaryotic membrane lipoprotein lipid attachment site profile. |
| 19 | 23 | Phobius | SIGNAL_PEPTIDE_C_REGION | C-terminal region of a signal peptide. |
| 82 | 165 | Pfam | PF02563 | Polysaccharide biosynthesis/export protein |
| 82 | 165 | InterPro | IPR003715 | Polysaccharide export protein |
3D Structure
Selected loaded structure. Experimental PDB entries may cover only a portion of the sequence; predicted models typically cover the full protein.
Loading 3D structure...
Structural evidence
0 + 2Experimental PDB entries and predicted models. Click Switch to display a different structure in the viewer.
| Entry | Method | Resolution | Chain | Coverage | Links | Status |
|---|---|---|---|---|---|---|
|
AlphaFold
AF_A0A024GWC8
|
AlphaFold | — | — | full sequence | — | Viewing |
|
ColabFold
KP13_03808
|
ColabFold | — | — | full sequence | — | Loaded |
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 |
|---|---|---|---|---|---|---|---|
| 2 | 0.452 | ||||||
| 7 | 0.272 |
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 |
|---|---|---|---|---|---|---|---|
| 26 | 0.209 |
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.
Highest-confidence structural evidence: ligands co-crystallized with this exact protein. If the source PDB is loaded in TPW, use Open crystal to inspect it in the structure viewer.
No PDB structure with a co-crystallized ligand found for this exact protein.
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.
| Ligand | Source crystal | UniProt (homolog) | MW · LogP · TPSA | Lipinski | PAINS | SMILES |
|---|---|---|---|---|---|---|
| HEX | Q9X4B7 | 86.2 Da LogP 2.59 TPSA 0.0 | ✓ Ro5 | ✓ Clean |
CCCCCC
|
|
| MTN | Q9X4B7 | 264.4 Da LogP 1.82 TPSA 57.3 | ✓ Ro5 | ✓ Clean |
CC1(C=C(C(N1[O])(C)C)CSS(=O)(=O)C)C
|
|
| OCT | Q9X4B7 | 114.2 Da LogP 3.37 TPSA 0.0 | ✓ Ro5 | ✓ Clean |
CCCCCCCC
|
Experimental bioactivity from ChEMBL measured directly on this protein. Score = pchembl (−log Ki/IC₅₀; higher = more potent).
No ChEMBL bioactivity data found for this exact protein.
Bioactivity inferred from similar proteins in ChEMBL. Score = pchembl (−log Ki/IC₅₀; higher = more potent).
No ChEMBL hits found through similar proteins.
Proposed virtual-screening candidates from ZINC. Score = Tanimoto similarity to a known binder (0–1; higher = more similar).
| Ligand | Tanimoto | MW · LogP · TPSA | Lipinski | PAINS | SMILES |
|---|---|---|---|---|---|
| ZINC1545440 | 0.538 | 213.4 Da LogP 4.65 TPSA 26.0 | ✓ Ro5 | ✓ Clean |
CCCCCCCCCCCCCCN
|
| ZINC1599570 | 0.538 | 227.4 Da LogP 4.86 TPSA 3.2 | ✓ Ro5 | ✓ Clean |
CCCCCN(CCCCC)CCCCC
|
| ZINC1644076 | 0.538 | 214.4 Da LogP 4.68 TPSA 20.2 | ✓ Ro5 | ✓ Clean |
CCCCCCCCCCCCCCO
|
| ZINC1680803 | 0.538 | 200.4 Da LogP 4.29 TPSA 20.2 | ✓ Ro5 | ✓ Clean |
CCCCCCCCCCCCCO
|
| ZINC195766643 | 0.538 | 231.9 Da LogP 2.93 TPSA 0.0 | ✓ Ro5 | ✓ Clean |
CCCCCCCC[Sn+3]
|
| ZINC196468891 | 0.538 | 261.0 Da LogP 3.91 TPSA 0.0 | ✓ Ro5 | ✓ Clean |
CCCCC[Sn+2]CCCCC
|
| ZINC59144932 | 0.538 | 202.4 Da LogP 4.84 TPSA 0.0 | ✓ Ro5 | ✓ Clean |
CCCCCCCCCCCCS
|
| ZINC100027350 | 0.500 | 227.4 Da LogP 4.91 TPSA 12.0 | ✓ Ro5 | ✓ Clean |
CCCCCCCCNCCCCCCC
|
| ZINC1627284 | 0.500 | 214.4 Da LogP 4.94 TPSA 9.2 | ✓ Ro5 | ✓ Clean |
CCCCCCCOCCCCCCC
|
| ZINC1699899 | 0.500 | 202.4 Da LogP 4.88 TPSA 0.0 | ✓ Ro5 | ✓ Clean |
CCCCCCSCCCCCC
|
| ZINC1724011 | 0.500 | 213.4 Da LogP 4.52 TPSA 12.0 | ✓ Ro5 | ✓ Clean |
CCCCCCCNCCCCCCC
|
| ZINC2564179 | 0.500 | 214.4 Da LogP 4.94 TPSA 9.2 | ✓ Ro5 | ✓ Clean |
CCCCCCCCOCCCCCC
|
| ZINC32164811 | 0.500 | 213.4 Da LogP 4.47 TPSA 3.2 | ✓ Ro5 | ✓ Clean |
CCCCCN(CCCC)CCCCC
|
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.