Measured experimental coordinates · Phase 6C.1
9FOC · NSD2 PWWP1
Source chain B, canonical annotation-core residues 222–286. X-RAY DIFFRACTION · reported 1.618 Å. Original-coordinate SHA-256: 8ae5d68a73d09d1007d3171e7649074a9b67184d587435cc50eba2241f68c269.
Open deposited-coordinate molecular viewer Protein/domain context Original PDB entry
Model-aware structural assessment
Counts concern the annotated PWWP core. Different NMR models are evaluated independently, without averaging their coordinates into an artificial model.
| Model | Core residues observed | Missing backbone | Missing side-chain (union) | Missing side-chain (consistent conformer) | Partial occupancy residues | Unassessable chemistry |
|---|---|---|---|---|---|---|
| 1 | 65 | 0 | 11 | 11 | 0 | 0 |
Experimental ligand environments
Only separately source-classified research ligands are listed. Native annotation-core contacts and broader Pfam-fold contacts are identified separately. A simple distance is not an experimental affinity or density-quality score.
A1IEG · calculated observed ligand environment
Deposited instance PDB:9FOC:LIG:E:A1IEG:401:.. Closest calculated PWWP-region atom distance: 2.9114 Å. Five-Å native core contacts: 11; broader-Pfam contacts: 1; source-coordinate model 1.
Limitations: partial occupancy contact atoms; representative alt conformers selected
| Canonical residue | Region | Protein atom | Ligand atom | Distance (Å) | Occupancy |
|---|---|---|---|---|---|
| 230 VAL | native annotation core | CG1 | C8 | 3.7336 | 1.0 / 0.5 |
| 233 TYR | native annotation core | OH | C6 | 3.3682 | 1.0 / 0.5 |
| 234 PRO | native annotation core | O | C11 | 5.4582 | 1.0 / 0.5 |
| 236 TRP | native annotation core | CZ2 | C13 | 3.5049 | 1.0 / 0.5 |
| 266 PHE | native annotation core | CD2 | C11 | 3.7605 | 1.0 / 0.5 |
| 267 PHE | native annotation core | O | C15 | 3.7844 | 1.0 / 0.5 |
| 268 GLY | native annotation core | CA | O1 | 3.2494 | 1.0 / 0.5 |
| 269 ASP | native annotation core | OD1 | O2 | 3.1354 | 1.0 / 0.5 |
| 270 ALA | native annotation core | CB | O2 | 3.2747 | 1.0 / 0.5 |
| 271 PRO | native annotation core | O | C | 3.5955 | 1.0 / 0.5 |
| 272 GLU | native annotation core | OE2 | N | 2.9114 | 1.0 / 0.5 |
| 273 ARG | native annotation core | O | C8 | 5.3603 | 1.0 / 0.5 |
| 274 ALA | native annotation core | CB | C8 | 4.8114 | 1.0 / 0.5 |
| 276 ILE | native annotation core | CD1 | C8 | 5.9736 | 1.0 / 0.5 |
| 321 GLN | broader pfam outside annotation core | NE2 | O2 | 3.3493 | 1.0 / 0.5 |
A1IFS · calculated observed ligand environment
Deposited instance PDB:9FOC:LIG:F:A1IFS:402:.. Closest calculated PWWP-region atom distance: 2.8919 Å. Five-Å native core contacts: 11; broader-Pfam contacts: 1; source-coordinate model 1.
Limitations: partial occupancy contact atoms; representative alt conformers selected
| Canonical residue | Region | Protein atom | Ligand atom | Distance (Å) | Occupancy |
|---|---|---|---|---|---|
| 230 VAL | native annotation core | CG1 | C8 | 3.8905 | 1.0 / 0.5 |
| 233 TYR | native annotation core | CZ | N3 | 3.315 | 1.0 / 0.5 |
| 234 PRO | native annotation core | O | C11 | 5.3059 | 1.0 / 0.5 |
| 236 TRP | native annotation core | CZ2 | O1 | 3.6525 | 1.0 / 0.5 |
| 266 PHE | native annotation core | CB | C14 | 3.7681 | 1.0 / 0.5 |
| 267 PHE | native annotation core | O | O1 | 3.7673 | 1.0 / 0.5 |
| 268 GLY | native annotation core | CA | O1 | 3.1338 | 1.0 / 0.5 |
| 269 ASP | native annotation core | OD1 | O2 | 3.1168 | 1.0 / 0.5 |
| 270 ALA | native annotation core | CB | O2 | 3.413 | 1.0 / 0.5 |
| 271 PRO | native annotation core | O | C | 3.5697 | 1.0 / 0.5 |
| 272 GLU | native annotation core | OE2 | N | 2.8919 | 1.0 / 0.5 |
| 273 ARG | native annotation core | O | C8 | 5.1792 | 1.0 / 0.5 |
| 274 ALA | native annotation core | CB | C8 | 4.6848 | 1.0 / 0.5 |
| 276 ILE | native annotation core | CD1 | C8 | 5.9517 | 1.0 / 0.5 |
| 321 GLN | broader pfam outside annotation core | NE2 | O2 | 3.2742 | 1.0 / 0.5 |
Residue-level coordinate and atom completeness
"Missing" applies only to residues with observed atoms and supported chemical templates. Unobserved residues are reported separately. Alternate-conformer union presence is distinct from a single internally consistent conformer.
| Canonical / entity position | Component | Observed | Missing backbone | Missing side-chain (union) | Missing side-chain (consistent) | Alt & occupancy |
|---|---|---|---|---|---|---|
| 222 / 19 | VAL | Yes | — | — | — | —; occupancy ≥ 1.0 |
| 223 / 20 | GLY | Yes | — | — | — | —; occupancy ≥ 1.0 |
| 224 / 21 | ASP | Yes | — | — | — | —; occupancy ≥ 1.0 |
| 225 / 22 | LEU | Yes | — | — | — | —; occupancy ≥ 1.0 |
| 226 / 23 | VAL | Yes | — | — | — | —; occupancy ≥ 1.0 |
| 227 / 24 | TRP | Yes | — | — | — | —; occupancy ≥ 1.0 |
| 228 / 25 | SER | Yes | — | — | — | —; occupancy ≥ 1.0 |
| 229 / 26 | LYS | Yes | — | — | — | —; occupancy ≥ 1.0 |
| 230 / 27 | VAL | Yes | — | — | — | —; occupancy ≥ 1.0 |
| 231 / 28 | SER | Yes | — | — | — | —; occupancy ≥ 1.0 |
| 232 / 29 | GLY | Yes | — | — | — | —; occupancy ≥ 1.0 |
| 233 / 30 | TYR | Yes | — | — | — | —; occupancy ≥ 1.0 |
| 234 / 31 | PRO | Yes | — | — | — | —; occupancy ≥ 1.0 |
| 235 / 32 | TRP | Yes | — | — | — | —; occupancy ≥ 1.0 |
| 236 / 33 | TRP | Yes | — | — | — | —; occupancy ≥ 1.0 |
| 237 / 34 | PRO | Yes | — | — | — | —; occupancy ≥ 1.0 |
| 238 / 35 | CYS | Yes | — | — | — | —; occupancy ≥ 1.0 |
| 239 / 36 | MET | Yes | — | — | — | —; occupancy ≥ 1.0 |
| 240 / 37 | VAL | Yes | — | — | — | —; occupancy ≥ 1.0 |
| 241 / 38 | SER | Yes | — | — | — | —; occupancy ≥ 1.0 |
| 242 / 39 | ALA | Yes | — | — | — | —; occupancy ≥ 1.0 |
| 243 / 40 | ASP | Yes | — | — | — | —; occupancy ≥ 1.0 |
| 244 / 41 | PRO | Yes | — | — | — | —; occupancy ≥ 1.0 |
| 245 / 42 | LEU | Yes | — | — | — | —; occupancy ≥ 1.0 |
| 246 / 43 | LEU | Yes | — | — | — | —; occupancy ≥ 1.0 |
| 247 / 44 | HIS | Yes | — | — | — | —; occupancy ≥ 1.0 |
| 248 / 45 | SER | Yes | — | — | — | —; occupancy ≥ 1.0 |
| 249 / 46 | TYR | Yes | — | — | — | —; occupancy ≥ 1.0 |
| 250 / 47 | THR | Yes | — | — | — | —; occupancy ≥ 1.0 |
| 251 / 48 | LYS | Yes | — | — | — | —; occupancy ≥ 1.0 |
| 252 / 49 | LEU | Yes | — | — | — | —; occupancy ≥ 1.0 |
| 253 / 50 | LYS | Yes | — | — | — | —; occupancy ≥ 1.0 |
| 254 / 51 | GLY | Yes | — | — | — | —; occupancy ≥ 1.0 |
| 255 / 52 | GLN | Yes | — | CD, CG, NE2, OE1 | CD, CG, NE2, OE1 | —; occupancy ≥ 1.0 |
| 256 / 53 | LYS | Yes | — | CD, CE, NZ | CD, CE, NZ | —; occupancy ≥ 1.0 |
| 257 / 54 | LYS | Yes | — | CD, CE, CG, NZ | CD, CE, CG, NZ | —; occupancy ≥ 1.0 |
| 258 / 55 | SER | Yes | — | — | — | —; occupancy ≥ 1.0 |
| 259 / 56 | ALA | Yes | — | — | — | —; occupancy ≥ 1.0 |
| 260 / 57 | ARG | Yes | — | — | — | —; occupancy ≥ 1.0 |
| 261 / 58 | GLN | Yes | — | — | — | —; occupancy ≥ 1.0 |
| 262 / 59 | TYR | Yes | — | — | — | —; occupancy ≥ 1.0 |
| 263 / 60 | HIS | Yes | — | — | — | —; occupancy ≥ 1.0 |
| 264 / 61 | VAL | Yes | — | — | — | —; occupancy ≥ 1.0 |
| 265 / 62 | GLN | Yes | — | — | — | —; occupancy ≥ 1.0 |
| 266 / 63 | PHE | Yes | — | — | — | —; occupancy ≥ 1.0 |
| 267 / 64 | PHE | Yes | — | — | — | —; occupancy ≥ 1.0 |
| 268 / 65 | GLY | Yes | — | — | — | —; occupancy ≥ 1.0 |
| 269 / 66 | ASP | Yes | — | — | — | —; occupancy ≥ 1.0 |
| 270 / 67 | ALA | Yes | — | — | — | —; occupancy ≥ 1.0 |
| 271 / 68 | PRO | Yes | — | — | — | —; occupancy ≥ 1.0 |
| 272 / 69 | GLU | Yes | — | — | — | —; occupancy ≥ 1.0 |
| 273 / 70 | ARG | Yes | — | — | — | —; occupancy ≥ 1.0 |
| 274 / 71 | ALA | Yes | — | — | — | —; occupancy ≥ 1.0 |
| 275 / 72 | TRP | Yes | — | — | — | —; occupancy ≥ 1.0 |
| 276 / 73 | ILE | Yes | — | — | — | —; occupancy ≥ 1.0 |
| 277 / 74 | PHE | Yes | — | — | — | —; occupancy ≥ 1.0 |
| 278 / 75 | GLU | Yes | — | — | — | —; occupancy ≥ 1.0 |
| 279 / 76 | LYS | Yes | — | — | — | —; occupancy ≥ 1.0 |
| 280 / 77 | SER | Yes | — | — | — | —; occupancy ≥ 1.0 |
| 281 / 78 | LEU | Yes | — | — | — | —; occupancy ≥ 1.0 |
| 282 / 79 | VAL | Yes | — | — | — | —; occupancy ≥ 1.0 |
| 283 / 80 | ALA | Yes | — | — | — | —; occupancy ≥ 1.0 |
| 284 / 81 | PHE | Yes | — | — | — | —; occupancy ≥ 1.0 |
| 285 / 82 | GLU | Yes | — | — | — | —; occupancy ≥ 1.0 |
| 286 / 83 | GLY | Yes | — | — | — | —; occupancy ≥ 1.0 |
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