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

Exact experimental source · Phase 6D

5NRR · 96E

UP:Q9UBC3:PWWP1 · protein label chain B · ligand label chain G · model 1

Original structure and viewer
10Protein-chain contacts within 5 Å
14Protein-chain contacts within 6 Å
5Qualified local alignment positions
0Side-chain incomplete residues in local neighborhood

Identity and provenance

Source evidence
phase6a:site_classification:PDB:5NRR:LIG:G:96E:401:.:SITE:UP:Q9UBC3:PWWP1:B
Original mmCIF SHA-256
ab09d824a29b987279f6178899a03ddb8e496509769ce2e3558b670c6826e1e0
Experimental method
'X-RAY DIFFRACTION'
Source site class
deposited_research_ligand · source_observed
Assembly context
asymmetric_unit_only
Fingerprint
11 qualified aligned contact positions
View original Phase 6C.1 ligand environment

Original experimental coordinates

Load the exact deposited source bytes; the browser verifies the original SHA-256 before drawing. Contacting protein residues and the specified ligand are highlighted only where the local parser can uniquely match source chain and residue identifiers. Otherwise the unmodified deposited structure remains available without an invented interaction highlight.

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Measured residue contacts

The table shows deposited protein-chain residue geometry, including native sequence identifiers. The listed contact atoms are selected under explicit alternate-conformer policy.

Label residueResidueCanonical positionMSA columnMin. heavy-atom distanceContact atoms
92SERUnmappedUnqualified2.781 ÅOG · O13
61ASP2661453.094 ÅOD2 · C03
58TRP2631423.584 ÅCZ2 · C07
28ILE233323.595 ÅCG1 · C07
34TRP239483.799 ÅCG · C06
31PHE236453.850 ÅCD1 · C06
63LYS2681523.910 ÅCD · C02
90LEUUnmappedUnqualified4.284 ÅCD1 · O13
65SER2701544.290 ÅOG · O01
26GLY231304.911 ÅO · C07
32SER237465.007 ÅO · C07
27LYS232315.513 ÅC · C07
64PHE2691535.642 ÅO · O01
93TYRUnmappedUnqualified5.837 ÅN · O13

Local atomic completeness

Label residueTypeCanonicalObserved conformerMissing backboneMissing side chain
31PHE236single / commonNoneNone
34TRP239BNoneNone
58TRP263single / commonNoneNone
61ASP266single / commonNoneNone
63LYS268single / commonNoneNone
92SER—single / commonNoneNone

Compare experimental site geometry

For nonredundant comparison this deposited instance uses source-qualified within-entry representative PDB:5NRR:LIG:C:96E:401:.:SITE:UP:Q9UBC3:PWWP1:A. Both original records remain separately accessible.

Further comparisons

All research-ligand observations for this domain · Original structural quality · Chemical classifications and assays