SIMILAR PATTERN OF AMINO ACIDS MAPPED TO 'CHT'
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. | 1GRM_A_DVAA6_0 (GRAMICIDIN A) |
4cnl | PUTATIVEPNEUMOCOCCAL SURFACEPROTEIN (Streptococcuspneumoniae) | 3 / 3 | ALA A 222VAL A 215TRP A 214 | NoneNoneCHT A1275 (-3.5A) | 0.93A | 1grmA-4cnlA:undetectable | 1grmA-4cnlA:4.52 | ||
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. | 1GRM_B_DVAB6_0 (GRAMICIDIN A) |
4cnl | PUTATIVEPNEUMOCOCCAL SURFACEPROTEIN (Streptococcuspneumoniae) | 3 / 3 | ALA A 222VAL A 215TRP A 214 | NoneNoneCHT A1275 (-3.5A) | 0.93A | 1grmB-4cnlA:undetectable | 1grmB-4cnlA:4.52 | ||
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. | 2FCN_B_DVAB35_0 (UBIQUITIN) |
3c5i | CHOLINE KINASE (Plasmodiumknowlesi) | 4 / 6 | ARG A 348LEU A 321GLU A 254ILE A 253 | CHT A1001 ( 4.8A)None CA A 371 ( 3.4A)GOL A1003 (-4.3A) | 0.97A | 2fcnA-3c5iA:undetectable2fcnB-3c5iA:undetectable | 2fcnA-3c5iA:11.782fcnB-3c5iA:11.78 | ||
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. | 2NYR_B_SVRB401_2 (NAD-DEPENDENTDEACETYLASESIRTUIN-5) |
3c5i | CHOLINE KINASE (Plasmodiumknowlesi) | 4 / 6 | PHE A 267GLN A 220ASN A 222LEU A 132 | NoneCHT A1001 (-3.2A) MG A 370 ( 4.4A)None | 1.24A | 2nyrA-3c5iA:undetectable | 2nyrA-3c5iA:20.38 | ||
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. | 2X8O_A_OINA1317_1 (CHOLINE-BINDINGPROTEIN F) |
1h8g | MAJOR AUTOLYSIN (Streptococcuspneumoniae) | 4 / 4 | TRP A 241TRP A 248TYR A 269MET A 278 | CHT A 402 ( 4.2A)CHT A 402 (-3.8A)CHT A 402 (-4.9A)CHT A 402 ( 4.1A) | 0.27A | 2x8oA-1h8gA:8.5 | 2x8oA-1h8gA:15.92 | ||
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. | 2X8O_A_OINA1317_1 (CHOLINE-BINDINGPROTEIN F) |
2wwd | 1,4-BETA-N-ACETYLMURAMIDASE (Streptococcuspneumoniae) | 4 / 4 | TRP A 59TRP A 68TYR A 86MET A 94 | CHT A 702 (-3.6A)CHT A 702 (-3.9A)CHT A 702 (-3.7A)CHT A 702 ( 3.5A) | 0.64A | 2x8oA-2wwdA:10.6 | 2x8oA-2wwdA:22.36 | ||
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. | 2X8O_A_OINA1317_1 (CHOLINE-BINDINGPROTEIN F) |
2wwd | 1,4-BETA-N-ACETYLMURAMIDASE (Streptococcuspneumoniae) | 4 / 4 | TRP A 99TRP A 108TYR A 130MET A 138 | CHT A 704 (-3.7A)CHT A 704 (-3.6A)CHT A 704 (-4.6A)CHT A 704 (-3.4A) | 0.31A | 2x8oA-2wwdA:10.6 | 2x8oA-2wwdA:22.36 | ||
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. | 2X8O_A_OINA1317_1 (CHOLINE-BINDINGPROTEIN F) |
2wwd | 1,4-BETA-N-ACETYLMURAMIDASE (Streptococcuspneumoniae) | 4 / 4 | TRP A 122TRP A 129TYR A 147MET A 155 | CHT A 705 ( 3.7A)CHT A 705 (-4.1A)CHT A 705 ( 4.0A)CHT A 705 ( 4.1A) | 0.80A | 2x8oA-2wwdA:10.6 | 2x8oA-2wwdA:22.36 | ||
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target. | 2X8O_A_OINA1317_1 (CHOLINE-BINDINGPROTEIN F) |
2x8p | CHOLINE-BINDINGPROTEIN F (Streptococcuspneumoniae) | 4 / 4 | TRP A 130TRP A 137TYR A 182MET A 190 | CHT A1321 (-4.0A)CHT A1321 (-3.9A)NoneCHT A1321 (-3.5A) | 0.22A | 2x8oA-2x8pA:37.2 | 2x8oA-2x8pA:100.00 | ||
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target. | 2X8O_A_OINA1317_1 (CHOLINE-BINDINGPROTEIN F) |
2x8p | CHOLINE-BINDINGPROTEIN F (Streptococcuspneumoniae) | 4 / 4 | TRP A 214TRP A 221TYR A 243MET A 251 | CHT A1320 (-3.8A)CHT A1320 (-3.6A)NoneCHT A1320 ( 4.6A) | 0.18A | 2x8oA-2x8pA:37.2 | 2x8oA-2x8pA:100.00 | ||
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target. | 2X8O_A_OINA1317_1 (CHOLINE-BINDINGPROTEIN F) |
2x8p | CHOLINE-BINDINGPROTEIN F (Streptococcuspneumoniae) | 4 / 4 | TRP A 235TRP A 242TYR A 263MET A 272 | CHT A1319 (-3.6A)CHT A1319 (-3.9A)NoneCHT A1319 ( 4.5A) | 0.26A | 2x8oA-2x8pA:37.2 | 2x8oA-2x8pA:100.00 | ||
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. | 2X8O_A_OINA1317_1 (CHOLINE-BINDINGPROTEIN F) |
4cnl | PUTATIVEPNEUMOCOCCAL SURFACEPROTEIN (Streptococcuspneumoniae) | 4 / 4 | TRP A 96TRP A 103TYR A 121MET A 129 | CHT A1276 (-3.3A)CHT A1276 ( 3.9A)CHT A1276 ( 3.8A)CHT A1276 ( 3.7A) | 0.60A | 2x8oA-4cnlA:10.9 | 2x8oA-4cnlA:29.15 | ||
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. | 2X8O_A_OINA1317_1 (CHOLINE-BINDINGPROTEIN F) |
4cnl | PUTATIVEPNEUMOCOCCAL SURFACEPROTEIN (Streptococcuspneumoniae) | 4 / 4 | TRP A 134TRP A 143TYR A 161MET A 169 | CHT A1280 (-3.4A)CHT A1280 ( 3.7A)CHT A1280 (-3.6A)CHT A1280 (-3.6A) | 0.77A | 2x8oA-4cnlA:10.9 | 2x8oA-4cnlA:29.15 | ||
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. | 2X8O_A_OINA1317_1 (CHOLINE-BINDINGPROTEIN F) |
4cnl | PUTATIVEPNEUMOCOCCAL SURFACEPROTEIN (Streptococcuspneumoniae) | 4 / 4 | TRP A 174TRP A 183TYR A 201MET A 209 | CHT A1274 (-3.2A)CHT A1274 (-3.6A)CHT A1274 (-3.5A)CHT A1274 (-3.4A) | 0.73A | 2x8oA-4cnlA:10.9 | 2x8oA-4cnlA:29.15 | ||
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. | 2X8O_A_OINA1317_1 (CHOLINE-BINDINGPROTEIN F) |
4cnl | PUTATIVEPNEUMOCOCCAL SURFACEPROTEIN (Streptococcuspneumoniae) | 4 / 4 | TRP A 214TRP A 223TYR A 241MET A 249 | CHT A1275 (-3.5A)CHT A1275 (-3.6A)CHT A1275 (-3.7A)CHT A1275 (-3.6A) | 0.78A | 2x8oA-4cnlA:10.9 | 2x8oA-4cnlA:29.15 | ||
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. | 2X8O_A_OINA1317_1 (CHOLINE-BINDINGPROTEIN F) |
4iwt | LYTIC AMIDASE (Streptococcuspneumoniae) | 4 / 4 | TRP A 220TRP A 228TYR A 249MET A 257 | CHT A 401 (-3.5A)CHT A 401 (-3.9A)NoneCHT A 401 ( 4.4A) | 0.38A | 2x8oA-4iwtA:7.2 | 2x8oA-4iwtA:24.76 | ||
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. | 2X8O_A_OINA1317_1 (CHOLINE-BINDINGPROTEIN F) |
4iwt | LYTIC AMIDASE (Streptococcuspneumoniae) | 4 / 4 | TRP A 241TRP A 248TYR A 269MET A 278 | CHT A 402 (-3.5A)CHT A 402 (-3.7A)CHT A 402 (-4.2A)CHT A 402 ( 3.8A) | 0.74A | 2x8oA-4iwtA:7.2 | 2x8oA-4iwtA:24.76 | ||
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target. | 2X8O_A_OINA1317_1 (CHOLINE-BINDINGPROTEIN F) |
4x36 | AUTOLYSIN (Streptococcuspneumoniae) | 4 / 4 | TRP A 220TRP A 228TYR A 249MET A 257 | CHT A 408 (-3.7A)CHT A 408 (-3.5A)CHT A 408 ( 4.7A)CHT A 408 ( 3.7A) | 0.36A | 2x8oA-4x36A:6.9 | 2x8oA-4x36A:30.64 | ||
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target. | 2X8O_A_OINA1317_1 (CHOLINE-BINDINGPROTEIN F) |
4x36 | AUTOLYSIN (Streptococcuspneumoniae) | 4 / 4 | TRP A 241TRP A 248TYR A 269MET A 278 | CHT A 409 ( 3.7A)CHT A 409 (-3.8A)CHT A 409 (-4.0A)CHT A 409 ( 4.1A) | 0.97A | 2x8oA-4x36A:6.9 | 2x8oA-4x36A:30.64 | ||
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. | 2X8P_A_OINA1313_1 (CHOLINE-BINDINGPROTEIN F) |
1h8g | MAJOR AUTOLYSIN (Streptococcuspneumoniae) | 4 / 4 | TRP A 241LYS A 243TRP A 248TYR A 269 | CHT A 402 ( 4.2A)NoneCHT A 402 (-3.8A)CHT A 402 (-4.9A) | 0.38A | 2x8pA-1h8gA:5.8 | 2x8pA-1h8gA:15.92 | ||
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. | 2X8P_A_OINA1313_1 (CHOLINE-BINDINGPROTEIN F) |
4cnl | PUTATIVEPNEUMOCOCCAL SURFACEPROTEIN (Streptococcuspneumoniae) | 4 / 4 | TRP A 96LYS A 98TRP A 103TYR A 121 | CHT A1276 (-3.3A)NoneCHT A1276 ( 3.9A)CHT A1276 ( 3.8A) | 0.73A | 2x8pA-4cnlA:11.7 | 2x8pA-4cnlA:29.15 | ||
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. | 2X8P_A_OINA1313_1 (CHOLINE-BINDINGPROTEIN F) |
4iwt | LYTIC AMIDASE (Streptococcuspneumoniae) | 4 / 4 | TRP A 220LYS A 222TRP A 228TYR A 249 | CHT A 401 (-3.5A)NoneCHT A 401 (-3.9A)None | 0.38A | 2x8pA-4iwtA:7.4 | 2x8pA-4iwtA:24.76 | ||
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target. | 2X8P_A_OINA1313_1 (CHOLINE-BINDINGPROTEIN F) |
4x36 | AUTOLYSIN (Streptococcuspneumoniae) | 4 / 4 | TRP A 220LYS A 222TRP A 228TYR A 249 | CHT A 408 (-3.7A)NoneCHT A 408 (-3.5A)CHT A 408 ( 4.7A) | 0.40A | 2x8pA-4x36A:9.0 | 2x8pA-4x36A:30.64 | ||
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target. | 3MES_A_DMEA427_1 (CHOLINE KINASE) |
3c5i | CHOLINE KINASE (Plasmodiumknowlesi) | 8 / 10 | ASP A 218GLN A 220GLU A 254TYR A 259TRP A 322TRP A 325PHE A 339TYR A 344 | CHT A1001 (-2.8A)CHT A1001 (-3.2A) CA A 371 ( 3.4A)CHT A1001 ( 4.6A)CHT A1001 (-4.3A)CHT A1001 (-4.1A)NoneNone | 0.78A | 3mesA-3c5iA:38.7 | 3mesA-3c5iA:35.81 | ||
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target. | 3MES_A_DMEA427_1 (CHOLINE KINASE) |
3c5i | CHOLINE KINASE (Plasmodiumknowlesi) | 7 / 10 | GLN A 220ASN A 222GLU A 254TYR A 259TRP A 322PHE A 339TYR A 344 | CHT A1001 (-3.2A) MG A 370 ( 4.4A) CA A 371 ( 3.4A)CHT A1001 ( 4.6A)CHT A1001 (-4.3A)NoneNone | 1.02A | 3mesA-3c5iA:38.7 | 3mesA-3c5iA:35.81 | ||
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. | 3MES_A_DMEA427_1 (CHOLINE KINASE) |
4r7b | CHOLINE KINASE (Streptococcuspneumoniae) | 5 / 10 | ASP A 176GLU A 213TRP A 251TRP A 254TYR A 268 | CHT A 301 (-2.8A)CHT A 301 (-4.2A)CHT A 301 ( 3.6A)CHT A 301 (-3.9A)None | 0.79A | 3mesA-4r7bA:23.2 | 3mesA-4r7bA:29.81 | ||
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target. | 3MES_B_DMEB427_1 (CHOLINE KINASE) |
3c5i | CHOLINE KINASE (Plasmodiumknowlesi) | 8 / 10 | ASP A 218GLN A 220GLU A 254TYR A 259TRP A 322TRP A 325PHE A 339TYR A 344 | CHT A1001 (-2.8A)CHT A1001 (-3.2A) CA A 371 ( 3.4A)CHT A1001 ( 4.6A)CHT A1001 (-4.3A)CHT A1001 (-4.1A)NoneNone | 0.78A | 3mesB-3c5iA:38.7 | 3mesB-3c5iA:35.81 | ||
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target. | 3MES_B_DMEB427_1 (CHOLINE KINASE) |
3c5i | CHOLINE KINASE (Plasmodiumknowlesi) | 7 / 10 | GLN A 220ASN A 222GLU A 254TYR A 259TRP A 322PHE A 339TYR A 344 | CHT A1001 (-3.2A) MG A 370 ( 4.4A) CA A 371 ( 3.4A)CHT A1001 ( 4.6A)CHT A1001 (-4.3A)NoneNone | 1.03A | 3mesB-3c5iA:38.7 | 3mesB-3c5iA:35.81 | ||
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. | 3MES_B_DMEB427_1 (CHOLINE KINASE) |
4r7b | CHOLINE KINASE (Streptococcuspneumoniae) | 5 / 10 | ASP A 176GLU A 213TRP A 251TRP A 254TYR A 268 | CHT A 301 (-2.8A)CHT A 301 (-4.2A)CHT A 301 ( 3.6A)CHT A 301 (-3.9A)None | 0.82A | 3mesB-4r7bA:23.1 | 3mesB-4r7bA:29.81 | ||
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. | 3N9J_A_EAAA210_1 (GLUTATHIONES-TRANSFERASE P) |
4r7b | CHOLINE KINASE (Streptococcuspneumoniae) | 4 / 8 | TRP A 251ILE A 144TYR A 146GLY A 269 | CHT A 301 ( 3.6A)NoneNoneNone | 0.93A | 3n9jA-4r7bA:undetectable | 3n9jA-4r7bA:21.84 | ||
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. | 4ZZC_A_ACTA401_0 (PROTON-GATED IONCHANNEL) |
3c5i | CHOLINE KINASE (Plasmodiumknowlesi) | 4 / 6 | ILE A 269ARG A 348ILE A 253GLU A 254 | NoneCHT A1001 ( 4.8A)GOL A1003 (-4.3A) CA A 371 ( 3.4A) | 1.20A | 4zzcA-3c5iA:2.34zzcB-3c5iA:2.3 | 4zzcA-3c5iA:23.334zzcB-3c5iA:23.33 | ||
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. | 4ZZC_B_ACTB401_0 (PROTON-GATED IONCHANNEL) |
3c5i | CHOLINE KINASE (Plasmodiumknowlesi) | 4 / 6 | ILE A 269ARG A 348ILE A 253GLU A 254 | NoneCHT A1001 ( 4.8A)GOL A1003 (-4.3A) CA A 371 ( 3.4A) | 1.16A | 4zzcB-3c5iA:2.34zzcC-3c5iA:2.6 | 4zzcB-3c5iA:23.334zzcC-3c5iA:23.33 | ||
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. | 6DWD_C_GLYC713_0 (DEOXYNUCLEOSIDETRIPHOSPHATETRIPHOSPHOHYDROLASESAMHD1) |
3c5i | CHOLINE KINASE (Plasmodiumknowlesi) | 3 / 3 | GLN A 220TYR A 259ASN A 222 | CHT A1001 (-3.2A)CHT A1001 ( 4.6A) MG A 370 ( 4.4A) | 0.99A | 6dwdC-3c5iA:undetectable | 6dwdC-3c5iA:20.67 |