STRUCTURAL BIOLOGY & CHEMICAL EVIDENCEDataset v1.2 · Phase 6D · Comparative experimental recognition environments
Verified 2D molecular structure of CHLORIDE ION Verified 2D molecular structure of CHLORIDE ION

Resolved chemical identity

CHLORIDE ION

Other PDB component · not a studied ligand

complete_deposited_InChIKey

0 assay / association records0 preparations0 research-ligand PDB entries

No deposited PWWP research-ligand geometry is classified for this preparation in the selected release. Deposition of a buffer/ion is not binding evidence.

Clinical / development status: Not independently curated. A chemical probe classification does not imply medicinal approval.

Identity is separate from preparation

Chemical identity

Stable identity
INCHIKEY:VEXZGXHMUGYJMC-UHFFFAOYSA-M
Full InChIKey
VEXZGXHMUGYJMC-UHFFFAOYSA-M
Source identity status
complete deposited InChIKey
Deposited CCD identifiers
CL
External identifiers
See deposited identity and source links
Reference formula
Cl-
Calculated molecular weight
35.453
Calculated descriptors
cLogP -2.996 · TPSA 0.0 Ų · HBD 0 · HBA 0RDKit 2025.09.3; calculations for this source identity, not experimental measurements.
Depiction validation
verified smiles full inchikey match
SMILES, InChI & complete identity record
Isomeric SMILES
[Cl-]
InChI
Not curated
{
  "aliases": [
    "CHLORIDE ION"
  ],
  "ccd_ids": [
    "CL"
  ],
  "ccd_names": "[\"CHLORIDE ION\"]",
  "ccd_types": "[\"non-polymer\"]",
  "chemical_id": "INCHIKEY:VEXZGXHMUGYJMC-UHFFFAOYSA-M",
  "connectivity_block": "VEXZGXHMUGYJMC",
  "curated_source_sha256": null,
  "curation_version": "frozen-v1.2",
  "external_identifiers": {},
  "formal_charge_by_ccd": "{\"CL\": -1}",
  "formulae": "[\"Cl\"]",
  "geometry_note": "CCD ideal SDF is a reference chemical geometry, not a deposited bound pose.",
  "identity_status": "complete_deposited_InChIKey",
  "inchikey": "VEXZGXHMUGYJMC-UHFFFAOYSA-M",
  "inventory_origin": "v1_CCD_inventory",
  "isomeric_smiles": "[Cl-]",
  "primary_name": "CHLORIDE ION",
  "retrieval_date": "2026-10-24",
  "smiles_stereo_by_ccd": "{\"CL\": \"[Cl-]\"}",
  "source_metadata_sha256": "{\"CL\": \"9c98f20584954b21a3bac06cce1af3fa129f34a2f9294eab202725142ba7443e\"}",
  "source_urls": [
    "https://www.rcsb.org/ligand/CL"
  ]
}

Measured target and original context

Bioactivity & experimental observations

Download assay CSV

Each row is one source-specific observation. Repeated measurements of this compound are not independent compounds. Direct binding, functional displacement and cellular outcomes retain their distinct endpoints.

PreparationTested target & constructMethod / endpointOriginal observationConditions & uncertaintySource & verification
No observations match these filters. Missing curation is not evidence of biological inactivity.

Exact deposited instances

Experimental structures

Native-core and broader Pfam proximity are distinguished from contacts elsewhere in a protein. Each action opens the actual deposited ligand instance. Geometric proximity does not supply a measured binding affinity.

Entry / ligandNative domain & protein chainGeometric evidenceMinimum distanceInspect
5C6S · CLPDB:5C6S:LIG:C:CL:1302:.BRPF1 PWWP1Protein label chain A · ligand label chain Cnative annotation core contactionion or salt · other component. Deposited geometry is not solution affinity.Core: 2.9111 Å
Pfam: 2.9111 Å
View deposited instance

Preparations, identities and controls remain separate

Experimental context

No measured preparation is linked to this deposited identity in the curated snapshot.

Provenance and reproducibility

Sources & downloads

Snapshot 2026-10-26 · phase5-1.0.0 · original measurements, operators, constructs and uncertainty are retained in the exports.