SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3PY'
DrReposER ID / Desc. | Hit PDBID |
Hit Macromolecule |
Res. Matches |
Interface | HETATM | RMSD | Dali Z-score |
Seq. Identity (%) |
View | Dock | |
---|---|---|---|---|---|---|---|---|---|---|---|
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 1YA4_A_CTXA1_1 (CES1 PROTEIN) |
1hl2 | N-ACETYLNEURAMINATELYASE SUBUNIT (Escherichiacoli) | 6 / 12 | ALA A 10GLY A 46GLY A 45LEU A 12LEU A 13LEU A 22 | None3PY A 802 (-3.5A)NoneNoneNoneNone | 1.36A | 1ya4A-1hl2A:undetectable | 1ya4A-1hl2A:21.12 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 2ZM8_A_ACAA512_1 (6-AMINOHEXANOATE-DIMER HYDROLASE) |
1hl2 | N-ACETYLNEURAMINATELYASE SUBUNIT (Escherichiacoli) | 5 / 10 | TYR A 43TYR A 137SER A 47GLY A 189ILE A 206 | 3PY A 802 (-4.6A)3PY A 802 (-4.0A)3PY A 802 (-3.2A)None3PY A 802 ( 4.9A) | 1.28A | 2zm8A-1hl2A:0.0 | 2zm8A-1hl2A:23.97 | ||
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target. | 4BWL_C_MN9C1297_0 (N-ACETYLNEURAMINATELYASE) |
1hl2 | N-ACETYLNEURAMINATELYASE SUBUNIT (Escherichiacoli) | 9 / 10 | ILE A 139THR A 167GLY A 189TYR A 190ASP A 191GLU A 192GLY A 207SER A 208PHE A 252 | 3PY A 802 ( 4.9A)3PY A 802 (-3.6A)NoneNoneNoneNoneNoneNoneNone | 0.39A | 4bwlC-1hl2A:52.2 | 4bwlC-1hl2A:97.04 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 4UBE_A_2FAA401_2 (ADENOSINE KINASE) |
1hl2 | N-ACETYLNEURAMINATELYASE SUBUNIT (Escherichiacoli) | 4 / 4 | ALA A 10VAL A 44GLY A 49THR A 48 | NoneNoneNone3PY A 802 (-3.4A) | 0.96A | 4ubeA-1hl2A:2.9 | 4ubeA-1hl2A:23.84 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 5HIE_A_P06A801_2 (SERINE/THREONINE-PROTEIN KINASE B-RAF) |
1hl2 | N-ACETYLNEURAMINATELYASE SUBUNIT (Escherichiacoli) | 4 / 7 | ILE A 206GLY A 205PHE A 33ASP A 40 | 3PY A 802 ( 4.9A)NoneNoneNone | 0.73A | 5hieA-1hl2A:undetectable | 5hieA-1hl2A:22.79 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 5HIE_B_P06B801_2 (SERINE/THREONINE-PROTEIN KINASE B-RAF) |
1hl2 | N-ACETYLNEURAMINATELYASE SUBUNIT (Escherichiacoli) | 4 / 7 | ILE A 206GLY A 205PHE A 33ASP A 40 | 3PY A 802 ( 4.9A)NoneNoneNone | 0.73A | 5hieB-1hl2A:undetectable | 5hieB-1hl2A:22.79 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 5HIE_D_P06D801_2 (SERINE/THREONINE-PROTEIN KINASE B-RAF) |
1hl2 | N-ACETYLNEURAMINATELYASE SUBUNIT (Escherichiacoli) | 4 / 8 | ILE A 206GLY A 205PHE A 33ASP A 40 | 3PY A 802 ( 4.9A)NoneNoneNone | 0.75A | 5hieD-1hl2A:undetectable | 5hieD-1hl2A:22.79 | ||
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site. | 5IEO_A_VDYA206_2 (CDL2.3A) |
4dqd | EXTRACELLULARLIGAND-BINDINGRECEPTOR (Rhodopseudomonaspalustris) | 4 / 8 | ILE A 55PRO A 52ILE A 91LEU A 323 | None3PY A 404 (-3.9A)NoneNone | 1.01A | 5ieoA-4dqdA:undetectable | 5ieoA-4dqdA:16.52 |