SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2H3'
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. | 3AF3_A_PAUA314_0 (PANTOTHENATE KINASE) |
4n54 | INOSITOLDEHYDROGENASE (Lactobacilluscasei) | 4 / 6 | TYR A 247ARG A 290PHE A 287PHE A 295 | 2H3 A 402 (-4.5A)NoneNAI A 401 ( 3.7A)NAI A 401 (-4.9A) | 0.97A | 3af3A-4n54A:undetectable | 3af3A-4n54A:23.23 | ||
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. | 3KO0_J_TFPJ201_1 (PROTEIN S100-A4) |
4n54 | INOSITOLDEHYDROGENASE (Lactobacilluscasei) | 4 / 8 | PHE A 170PHE A 167GLY A 14MET A 183 | NAI A 401 (-4.1A)NoneNAI A 401 (-3.1A)2H3 A 402 (-3.5A) | 0.97A | 3ko0B-4n54A:undetectable3ko0J-4n54A:undetectable | 3ko0B-4n54A:13.883ko0J-4n54A:13.88 | ||
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. | 3KO0_M_TFPM201_1 (PROTEIN S100-A4) |
4n54 | INOSITOLDEHYDROGENASE (Lactobacilluscasei) | 4 / 7 | GLY A 14MET A 183PHE A 170PHE A 167 | NAI A 401 (-3.1A)2H3 A 402 (-3.5A)NAI A 401 (-4.1A)None | 0.88A | 3ko0M-4n54A:undetectable3ko0P-4n54A:undetectable | 3ko0M-4n54A:13.883ko0P-4n54A:13.88 | ||
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. | 3KO0_S_TFPS201_1 (PROTEIN S100-A4) |
4n54 | INOSITOLDEHYDROGENASE (Lactobacilluscasei) | 4 / 7 | PHE A 170PHE A 167GLY A 14MET A 183 | NAI A 401 (-4.1A)NoneNAI A 401 (-3.1A)2H3 A 402 (-3.5A) | 0.92A | 3ko0K-4n54A:undetectable3ko0S-4n54A:undetectable | 3ko0K-4n54A:13.883ko0S-4n54A:13.88 | ||
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. | 3KO0_T_TFPT201_1 (PROTEIN S100-A4) |
4n54 | INOSITOLDEHYDROGENASE (Lactobacilluscasei) | 4 / 7 | PHE A 170PHE A 167GLY A 14MET A 183 | NAI A 401 (-4.1A)NoneNAI A 401 (-3.1A)2H3 A 402 (-3.5A) | 0.99A | 3ko0R-4n54A:undetectable3ko0T-4n54A:undetectable | 3ko0R-4n54A:13.883ko0T-4n54A:13.88 | ||
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. | 3SUF_B_SUEB1201_3 (NS3 PROTEASE, NS4APROTEIN) |
4n54 | INOSITOLDEHYDROGENASE (Lactobacilluscasei) | 4 / 5 | ARG A 290PRO A 266TYR A 247VAL A 265 | NoneNone2H3 A 402 (-4.5A)None | 1.39A | 3sufC-4n54A:undetectable | 3sufC-4n54A:20.45 | ||
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. | 4KN2_C_LYAC304_1 (FOLATE RECEPTOR BETA) |
4n54 | INOSITOLDEHYDROGENASE (Lactobacilluscasei) | 5 / 12 | ASP A 159SER A 97HIS A 186GLY A 322TYR A 247 | 2H3 A 402 (-2.8A)None2H3 A 402 ( 3.8A)None2H3 A 402 (-4.5A) | 1.22A | 4kn2C-4n54A:undetectable | 4kn2C-4n54A:19.08 |