STRUCTURAL BIOLOGY & CHEMICAL EVIDENCEDataset v1.2 · Phase 6D · Comparative experimental recognition environments

Experimental coordinates · Exact deposited instances

Ligand contacts & pocket quality

Inspect the atoms that are present, the residues that are missing, and the precise scope of each chemical association.

NSD2 PWWP229HH · chain BPWWP_POCKET_QUALITY_1.0.0

Phase 6C historical atom / receptor assessment Phase 6C.1 full-atom experimental quality inventory

Full-coordinate Phase 6C.1 atom and ligand environment assessment

ExamplesNSD2 · UNC6934NSD3 · BI-932111OA · missing side chains

Source-verified molecular view

29HH · A1J20

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Atom completeness · selected chain and annotation core

What can these coordinates support?

Export selected evidence
Select a source-recorded contacting residue to inspect its deposited numbering.

A fully observed annotation core is not a complete-receptor certification. Short annotation intervals, absent peripheral residues, alternate conformers and unexamined density can limit structural interpretation. No receptor preparation was performed.

Frozen 5 Å heavy-atom proximity observations

Contacting residues · A1J20

12 full-chain residues

Heavy-atom distances use the first deposited model and asymmetric unit, occupancy >0 and retained alternate locations. No symmetry expansion or affinity inference. Proximity alone is not evidence of affinity or a functional interaction.

Canonical residueDeposited residueScopeMinimum distanceAtom qualityInspect
VAL 230B:230 · entity 230 · label Boutside PWWP annotations3.9833 ÅUnassessed
TYR 233B:233 · entity 233 · label Boutside PWWP annotations3.3145 ÅUnassessed
PHE 266B:266 · entity 266 · label Boutside PWWP annotations3.5520 ÅUnassessed
PHE 267B:267 · entity 267 · label Boutside PWWP annotations4.2992 ÅUnassessed
GLY 268B:268 · entity 268 · label Boutside PWWP annotations3.0163 ÅUnassessed
ASP 269B:269 · entity 269 · label Boutside PWWP annotations2.7909 ÅUnassessed
ALA 270B:270 · entity 270 · label Boutside PWWP annotations3.0957 ÅUnassessed
GLU 272B:272 · entity 272 · label Boutside PWWP annotations3.0303 ÅUnassessed
ARG 273B:273 · entity 273 · label Boutside PWWP annotations2.6632 ÅUnassessed
ALA 274B:274 · entity 274 · label Boutside PWWP annotations3.3807 ÅUnassessed
TRP 275B:275 · entity 275 · label Boutside PWWP annotations3.1605 ÅUnassessed
GLN 321B:321 · entity 321 · label Boutside PWWP annotations3.8436 ÅUnassessed

Identity, native target and exact site links

Linked experimental assays

Measured preparationMethod / endpointOriginal observationTested constructEvidence
No exact site-to-assay link is established in the frozen evidence graph. Visit the domain's Ligands & Bioactivity section for newly curated or structure-free observations.

Filterable structural assessment inventory

Coordinate coverage & quality

666 chain/domain records · 22 assessed for atom completeness
Export filtered CSVStructural gap inventory
4 selected chain/domain records. Ligand counts mean deposited proximity; all-atom completeness is assessed only where specified.
PDB / chainDomainCore Cα coveragePWWP-contact ligand instancesAtom assessmentMissing core heavy atoms
29HG · BNSD2 PWWP20 / 630Unassessed—
29HH · BNSD2 PWWP20 / 630Unassessed—
29HI · BNSD2 PWWP20 / 630Unassessed—
7CRO · KNSD2 PWWP20 / 630Unassessed—
Source bytes, methods and provenance

Detailed atom completeness only for the three packaged original-coordinate files; quality uses observed atom-name union across positive-occupancy alternate conformers, with per-alt differences retained. Missing entire residues are separate. Nonstandard amino-acid templates are unassessed. No density reinterpretation, receptor repair, docking or MD.

Coordinate SHA-256: d1d9bbfadba269f65d5b8dfcc21fdf9e6deedbdcec335be210174d043d4416b9

Source PDB: https://www.rcsb.org/structure/29HH. Original coordinate file: mmCIF. Original annotation and contact calculations are retained unchanged; the additional completeness assessment is PWWP_POCKET_QUALITY_1.0.0.

Methods and reproducible builder are included under analysis/phase5_pockets and scripts/build_phase5_pockets.py in the downloadable release.