Protein profile

KP13_03606

HTH-type transcriptional regulator CueR

Genome: KpKP13

Gene: AHE45949.1 cueR Structure source: AlphaFold + ColabFold UniProt A0A2W0PZ46
Amino acids 136
Annotations 6
Features 24
PDB binders 2
Druggability 0.362

Overview

Basic information about this protein and its source genome.

Accession
KP13_03606
Gene
AHE45949.1 cueR
Status
annotated
Amino acids
136
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)
N
DEG identity (%)
0.0
Localization
Cytoplasmic
ColabFold pLDDT
93.36

Selected Druggability evidence

AlphaFold / UniProt model

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 0.362
Structure A0A2W0PZ46
Pocket Pocket 5
P2Rank 0.018
Structure A0A2W0PZ46
Pocket Pocket 1
ColabFold model
FPocket 0.085 · Pocket 2
P2Rank 0.049 · Pocket 1
Core conservation Conserved core gene
Roary core
CoreCruncher core
Gut microbiome 124 / 4744 genomes with a hit
Normalized 0.026

Sequence

Primary amino-acid sequence viewer.

Functional Annotations

Enzyme classification and Gene Ontology terms linked to this protein.

6 GO

Gene Ontology (GO)

6
  • GO:0006355 Any process that modulates the frequency, rate or extent of cellular DNA-templated transcription.
  • GO:0045893 Any process that activates or increases the frequency, rate or extent of cellular DNA-templated transcription.
  • GO:0003700 A transcription regulator activity that modulates transcription of gene sets via selective and non-covalent binding to a specific double-stranded genomic DNA sequence (sometimes referred to as a motif) within a cis-regulatory region. Regulatory regions include promoters (proximal and distal) and enhancers. Genes are transcriptional units, and include bacterial operons.
  • GO:0005507 Binding to a copper (Cu) ion.
  • GO:0003677 Any molecular function by which a gene product interacts selectively and non-covalently with DNA (deoxyribonucleic acid).
  • GO:0005737 The contents of a cell excluding the plasma membrane and nucleus, but including other subcellular structures.

Sequence Features

Domain/signature hits from InterPro and related databases.

24 records
Show feature table
Start End DB Term Name
1 70 SMART SM00422 merrmega3
1 70 InterPro IPR000551 MerR-type HTH domain
1 69 ProSiteProfiles PS50937 MerR-type HTH domain profile.
1 69 InterPro IPR000551 MerR-type HTH domain
81 101 Coils Coil Coil
1 126 SUPERFAMILY SSF46955 Putative DNA-binding domain
1 126 InterPro IPR009061 Putative DNA-binding domain superfamily
1 110 Gene3D G3DSA:1.10.1660.10 -
2 13 PRINTS PR00040 MerR bacterial regulatory protein HTH signature
2 13 InterPro IPR000551 MerR-type HTH domain
13 26 PRINTS PR00040 MerR bacterial regulatory protein HTH signature
13 26 InterPro IPR000551 MerR-type HTH domain
37 57 PRINTS PR00040 MerR bacterial regulatory protein HTH signature
37 57 InterPro IPR000551 MerR-type HTH domain
1 112 PANTHER PTHR30204 REDOX-CYCLING DRUG-SENSING TRANSCRIPTIONAL ACTIVATOR SOXR
1 112 InterPro IPR047057 MerR transcriptional regulator
1 127 CDD cd01108 HTH_CueR
1 127 InterPro IPR011789 Cu(I)-responsive transcriptional regulator
4 26 ProSitePatterns PS00552 MerR-type HTH domain signature.
4 26 InterPro IPR000551 MerR-type HTH domain
1 67 Pfam PF13411 MerR HTH family regulatory protein
1 67 InterPro IPR000551 MerR-type HTH domain
1 126 NCBIfam TIGR02044 Cu(I)-responsive transcriptional regulator
1 126 InterPro IPR011789 Cu(I)-responsive transcriptional regulator

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 + 2

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

Entry Method Resolution Chain Coverage Links Status
AlphaFold AF_A0A2W0PZ46
AlphaFold full sequence Viewing
ColabFold KP13_03606
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
5 0.362

Pockets (P2RANK)

Showing top-ranked P2Rank candidates by probability. Probability is color-coded per P2Rank calibration: high (≥ 0.5), medium (0.2 – 0.49), low (< 0.2).

P2RANK Sticks Spheres Surfaces Score Probability Labels Zoom Positions
1 1.67 0.028

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.

2 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
DTT P0ACS2 154.3 Da LogP -0.43 TPSA 40.5 ✓ Ro5 ✓ Clean C([C@@H]([C@H](CS)O)O)S
FES P0ACS2 175.8 Da LogP 1.29 TPSA 0.0 ✓ Ro5 ✓ Clean S1[Fe]S[Fe]1

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.