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

Measured experimental coordinates · Phase 6C.1

2M16 · PSIP1 PWWP1

Source chain A, canonical annotation-core residues 1–64. SOLUTION NMR. Original-coordinate SHA-256: aef2070a848b7a2b73df3351f281a970ad2707bddd9a0dc142a560c9769cf6f6.

64Core residues with observed coordinates (64 annotated)
0Missing heavy side-chain atoms in observed core
20Experimental models evaluated
0Source-supported ligand environments

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.

ModelCore residues observedMissing backboneMissing side-chain (union)Missing side-chain (consistent conformer)Partial occupancy residuesUnassessable chemistry
16400000
26400000
36400000
46400000
56400000
66400000
76400000
86400000
96400000
106400000
116400000
126400000
136400000
146400000
156400000
166400000
176400000
186400000
196400000
206400000

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.

No verified research-ligand local environment is assigned to this chain/domain. It may be apo, structurally incomplete, or lack the necessary source-role verification.

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 positionComponentObservedMissing backboneMissing side-chain (union)Missing side-chain (consistent)Alt & occupancy
1 / 5METYes————; occupancy ≥ 1.0
2 / 6THRYes————; occupancy ≥ 1.0
3 / 7ARGYes————; occupancy ≥ 1.0
4 / 8ASPYes————; occupancy ≥ 1.0
5 / 9PHEYes————; occupancy ≥ 1.0
6 / 10LYSYes————; occupancy ≥ 1.0
7 / 11PROYes————; occupancy ≥ 1.0
8 / 12GLYYes————; occupancy ≥ 1.0
9 / 13ASPYes————; occupancy ≥ 1.0
10 / 14LEUYes————; occupancy ≥ 1.0
11 / 15ILEYes————; occupancy ≥ 1.0
12 / 16PHEYes————; occupancy ≥ 1.0
13 / 17ALAYes————; occupancy ≥ 1.0
14 / 18LYSYes————; occupancy ≥ 1.0
15 / 19METYes————; occupancy ≥ 1.0
16 / 20LYSYes————; occupancy ≥ 1.0
17 / 21GLYYes————; occupancy ≥ 1.0
18 / 22TYRYes————; occupancy ≥ 1.0
19 / 23PROYes————; occupancy ≥ 1.0
20 / 24HISYes————; occupancy ≥ 1.0
21 / 25TRPYes————; occupancy ≥ 1.0
22 / 26PROYes————; occupancy ≥ 1.0
23 / 27ALAYes————; occupancy ≥ 1.0
24 / 28ARGYes————; occupancy ≥ 1.0
25 / 29VALYes————; occupancy ≥ 1.0
26 / 30ASPYes————; occupancy ≥ 1.0
27 / 31GLUYes————; occupancy ≥ 1.0
28 / 32VALYes————; occupancy ≥ 1.0
29 / 33PROYes————; occupancy ≥ 1.0
30 / 34ASPYes————; occupancy ≥ 1.0
31 / 35GLYYes————; occupancy ≥ 1.0
32 / 36ALAYes————; occupancy ≥ 1.0
33 / 37VALYes————; occupancy ≥ 1.0
34 / 38LYSYes————; occupancy ≥ 1.0
35 / 39PROYes————; occupancy ≥ 1.0
36 / 40PROYes————; occupancy ≥ 1.0
37 / 41THRYes————; occupancy ≥ 1.0
38 / 42ASNYes————; occupancy ≥ 1.0
39 / 43LYSYes————; occupancy ≥ 1.0
40 / 44LEUYes————; occupancy ≥ 1.0
41 / 45PROYes————; occupancy ≥ 1.0
42 / 46ILEYes————; occupancy ≥ 1.0
43 / 47PHEYes————; occupancy ≥ 1.0
44 / 48PHEYes————; occupancy ≥ 1.0
45 / 49PHEYes————; occupancy ≥ 1.0
46 / 50GLYYes————; occupancy ≥ 1.0
47 / 51THRYes————; occupancy ≥ 1.0
48 / 52HISYes————; occupancy ≥ 1.0
49 / 53GLUYes————; occupancy ≥ 1.0
50 / 54THRYes————; occupancy ≥ 1.0
51 / 55ALAYes————; occupancy ≥ 1.0
52 / 56PHEYes————; occupancy ≥ 1.0
53 / 57LEUYes————; occupancy ≥ 1.0
54 / 58GLYYes————; occupancy ≥ 1.0
55 / 59PROYes————; occupancy ≥ 1.0
56 / 60LYSYes————; occupancy ≥ 1.0
57 / 61ASPYes————; occupancy ≥ 1.0
58 / 62ILEYes————; occupancy ≥ 1.0
59 / 63PHEYes————; occupancy ≥ 1.0
60 / 64PROYes————; occupancy ≥ 1.0
61 / 65TYRYes————; occupancy ≥ 1.0
62 / 66SERYes————; occupancy ≥ 1.0
63 / 67GLUYes————; occupancy ≥ 1.0
64 / 68ASNYes————; occupancy ≥ 1.0

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