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. 2023 Oct 5;14(5):e01655-23. doi: 10.1128/mbio.01655-23

TABLE 1.

Contacts of the (3-17)-N-terminal H3 P1 peptide with ankyrin domain (ANK), post-SET, and core-SET a c

H3 peptide ANK Post-SET Core-SET
Thr3 Asn232 Asp197
Lys Asp409
Ile447 b
Asp451
Asp448 (back)
Glu449 (back)
Tyr236 (stacking)
Gln5 Thr445
Tyr446 (stacking)
Thr6 Thr445 (backbone)
His489
Asn493 b
Ala7 His489
Phe492
Arg8 Asn234
Thr235
Lys9 (backbone) Tyr236
Ser10 Tyr236
Glu237
Glu238 (backbone)
Thr11 Thr235
Gly12 Thr235
Glu237
Gly13 Thr235 Lys170 (backbone)
Ala173 (backbone)
Tyr233
Lys14 Tyr148
Ser171 (backbone)
Ala173 (backbone)
Met174
Tyr175 (backbone)
Tyr233
SAM
Ala15 Met174
Phe204
Tyr233 (backbone)
Pro16 (backbone) Tyr175 (backbone)
Val176
Phe204
Asn234
Arg17 (backbone) Phe204 (backbone)
Asn234
Arg17 Glu206
a

Core-SET: 115–234aa; post-SET: 235–253aa; ANK: 256–545aa. Active site: Tyr233, corresponding to Tyr220 in the 532aa form and Tyr249 in the 561aa form.

b

Key residues connected to H3 peptides.

c

Contacts shorter than 3.65 Å are shown in bold; remaining are contacts closer than 4 Å.