SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2pb0'

List of Similar Pattern of Amino Acids

Hit pattern: 3D amino acid arrangements similar to known drug binding site
Query pattern: Residues from known binding site for annotated drug that match the hit pattern

(Click on the DrReposER ID to view details on interfaces and similar patterns of amino acids)
(Click on the view link on the last column to view superposed patterns of amino acids)

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	DrReposER ID / Desc.	Hit PDBID	Hit Macromolecule	Res. Matches	Interface	HETATM	RMSD	Dali Z-score	Seq. Identity (%)
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.	1FIQ_C_SALC1335_1 (XANTHINE OXIDASE)	2pb0	ACETYLORNITHINE/SUCC INYLDIAMINOPIMELATE AMINOTRANSFERASE (Salmonella enterica)	4 / 8	LEU A 251 PHE A 98 VAL A 102 LEU A 93	None	0.93A	1fiqC-2pb0A: undetectable	1fiqC-2pb0A: 19.56
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.	1ICR_A_NIOA604_1 (OXYGEN-INSENSITIVE NAD(P)H NITROREDUCTASE)	2pb0	ACETYLORNITHINE/SUCC INYLDIAMINOPIMELATE AMINOTRANSFERASE (Salmonella enterica)	4 / 5	THR A 205 PHE A 208 GLU A 207 GLY A 211	EDO A1004 ( 4.4A) None None None	1.16A	1icrA-2pb0A: undetectable 1icrB-2pb0A: undetectable	1icrA-2pb0A: 19.34 1icrB-2pb0A: 19.34
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.	1ICR_B_NIOB602_1 (OXYGEN-INSENSITIVE NAD(P)H NITROREDUCTASE)	2pb0	ACETYLORNITHINE/SUCC INYLDIAMINOPIMELATE AMINOTRANSFERASE (Salmonella enterica)	4 / 5	GLU A 207 GLY A 211 THR A 205 PHE A 208	None None EDO A1004 ( 4.4A) None	1.19A	1icrA-2pb0A: undetectable 1icrB-2pb0A: undetectable	1icrA-2pb0A: 19.34 1icrB-2pb0A: 19.34
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.	1ICU_B_NIOB219_1 (OXYGEN-INSENSITIVE NAD(P)H NITROREDUCTASE)	2pb0	ACETYLORNITHINE/SUCC INYLDIAMINOPIMELATE AMINOTRANSFERASE (Salmonella enterica)	4 / 6	GLU A 207 GLY A 211 THR A 205 PHE A 208	None None EDO A1004 ( 4.4A) None	1.14A	1icuA-2pb0A: undetectable 1icuB-2pb0A: undetectable	1icuA-2pb0A: 19.34 1icuB-2pb0A: 19.34
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.	1ICV_C_NIOC708_1 (OXYGEN-INSENSITIVE NAD(P)H NITROREDUCTASE)	2pb0	ACETYLORNITHINE/SUCC INYLDIAMINOPIMELATE AMINOTRANSFERASE (Salmonella enterica)	4 / 5	THR A 205 PHE A 208 GLU A 207 GLY A 211	EDO A1004 ( 4.4A) None None None	1.20A	1icvC-2pb0A: undetectable 1icvD-2pb0A: undetectable	1icvC-2pb0A: 19.34 1icvD-2pb0A: 19.34
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.	1ICV_D_NIOD706_1 (OXYGEN-INSENSITIVE NAD(P)H NITROREDUCTASE)	2pb0	ACETYLORNITHINE/SUCC INYLDIAMINOPIMELATE AMINOTRANSFERASE (Salmonella enterica)	4 / 5	GLU A 207 GLY A 211 THR A 205 PHE A 208	None None EDO A1004 ( 4.4A) None	1.16A	1icvC-2pb0A: undetectable 1icvD-2pb0A: undetectable	1icvC-2pb0A: 19.34 1icvD-2pb0A: 19.34
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.	1JHV_A_NIOA991_1 (NICOTINATE MONONUCLEOTIDE:5,6-D IMETHYLBENZIMIDAZOLE PHOSPHORIBOSYLTRANSF ERASE)	2pb0	ACETYLORNITHINE/SUCC INYLDIAMINOPIMELATE AMINOTRANSFERASE (Salmonella enterica)	4 / 8	GLY A 199 GLY A 337 LEU A 341 GLY A 343	None	0.77A	1jhvA-2pb0A: undetectable	1jhvA-2pb0A: 22.17
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.	1KQB_A_BEZA524_0 (OXYGEN-INSENSITIVE NAD(P)H NITROREDUCTASE)	2pb0	ACETYLORNITHINE/SUCC INYLDIAMINOPIMELATE AMINOTRANSFERASE (Salmonella enterica)	4 / 6	THR A 205 PHE A 208 GLU A 207 GLY A 211	EDO A1004 ( 4.4A) None None None	1.11A	1kqbA-2pb0A: undetectable 1kqbB-2pb0A: undetectable	1kqbA-2pb0A: 20.15 1kqbB-2pb0A: 20.15
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.	1KQB_B_BEZB525_0 (OXYGEN-INSENSITIVE NAD(P)H NITROREDUCTASE)	2pb0	ACETYLORNITHINE/SUCC INYLDIAMINOPIMELATE AMINOTRANSFERASE (Salmonella enterica)	4 / 5	GLU A 207 GLY A 211 THR A 205 PHE A 208	None None EDO A1004 ( 4.4A) None	1.16A	1kqbA-2pb0A: undetectable 1kqbB-2pb0A: undetectable	1kqbA-2pb0A: 20.15 1kqbB-2pb0A: 20.15
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.	1KQB_C_BEZC522_0 (OXYGEN-INSENSITIVE NAD(P)H NITROREDUCTASE)	2pb0	ACETYLORNITHINE/SUCC INYLDIAMINOPIMELATE AMINOTRANSFERASE (Salmonella enterica)	4 / 6	THR A 205 PHE A 208 GLU A 207 GLY A 211	EDO A1004 ( 4.4A) None None None	1.11A	1kqbC-2pb0A: undetectable 1kqbD-2pb0A: undetectable	1kqbC-2pb0A: 20.15 1kqbD-2pb0A: 20.15
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.	1KQB_D_BEZD523_0 (OXYGEN-INSENSITIVE NAD(P)H NITROREDUCTASE)	2pb0	ACETYLORNITHINE/SUCC INYLDIAMINOPIMELATE AMINOTRANSFERASE (Salmonella enterica)	4 / 6	GLU A 207 GLY A 211 THR A 205 PHE A 208	None None EDO A1004 ( 4.4A) None	1.16A	1kqbC-2pb0A: undetectable 1kqbD-2pb0A: undetectable	1kqbC-2pb0A: 20.15 1kqbD-2pb0A: 20.15
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.	1LIK_A_ADNA799_1 (ADENOSINE KINASE)	2pb0	ACETYLORNITHINE/SUCC INYLDIAMINOPIMELATE AMINOTRANSFERASE (Salmonella enterica)	5 / 10	THR A 148 VAL A 151 VAL A 191 ALA A 111 ALA A 115	None	1.03A	1likA-2pb0A: undetectable	1likA-2pb0A: 20.59
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.	1RUK_H_BEZH601_0 (IMMUNOGLOBULIN IGG2A, HEAVY CHAIN IMMUNOGLOBULIN IGG2A, LIGHT CHAIN)	2pb0	ACETYLORNITHINE/SUCC INYLDIAMINOPIMELATE AMINOTRANSFERASE (Salmonella enterica)	4 / 8	ALA A 96 LEU A 93 GLY A 90 GLY A 296	None	0.85A	1rukH-2pb0A: undetectable 1rukL-2pb0A: undetectable	1rukH-2pb0A: 20.11 1rukL-2pb0A: 20.84
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.	1WG8_A_SAMA3142_0 (PREDICTED S-ADENOSYLMETHIONINE -DEPENDENT METHYLTRANSFERASE)	2pb0	ACETYLORNITHINE/SUCC INYLDIAMINOPIMELATE AMINOTRANSFERASE (Salmonella enterica)	5 / 12	GLY A 200 GLY A 199 GLY A 197 ASP A 374 PHE A 332	None	1.13A	1wg8A-2pb0A: 3.3	1wg8A-2pb0A: 21.58
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.	1WG8_B_SAMB3141_0 (PREDICTED S-ADENOSYLMETHIONINE -DEPENDENT METHYLTRANSFERASE)	2pb0	ACETYLORNITHINE/SUCC INYLDIAMINOPIMELATE AMINOTRANSFERASE (Salmonella enterica)	5 / 12	GLY A 200 GLY A 199 GLY A 197 ASP A 374 PHE A 332	None	1.16A	1wg8B-2pb0A: 3.0	1wg8B-2pb0A: 21.58
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.	1XDK_B_9CRB600_1 (RETINOIC ACID RECEPTOR, BETA)	2pb0	ACETYLORNITHINE/SUCC INYLDIAMINOPIMELATE AMINOTRANSFERASE (Salmonella enterica)	5 / 12	PHE A 378 LEU A 346 ILE A 331 ILE A 325 PHE A 396	None	1.16A	1xdkB-2pb0A: undetectable	1xdkB-2pb0A: 19.91
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.	1YAJ_G_BEZG3385_0 (CES1 PROTEIN)	2pb0	ACETYLORNITHINE/SUCC INYLDIAMINOPIMELATE AMINOTRANSFERASE (Salmonella enterica)	3 / 3	SER A 253 VAL A 102 LEU A 267	None	0.67A	1yajG-2pb0A: undetectable	1yajG-2pb0A: 23.87
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.	2C6N_B_LPRB705_2 (ANGIOTENSIN-CONVERTI NG ENZYME, SOMATIC ISOFORM)	2pb0	ACETYLORNITHINE/SUCC INYLDIAMINOPIMELATE AMINOTRANSFERASE (Salmonella enterica)	3 / 3	ALA A 115 THR A 252 PHE A 147	None	0.68A	2c6nB-2pb0A: undetectable	2c6nB-2pb0A: 19.97
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.	2YFX_A_VGHA9000_1 (TYROSINE-PROTEIN KINASE RECEPTOR)	2pb0	ACETYLORNITHINE/SUCC INYLDIAMINOPIMELATE AMINOTRANSFERASE (Salmonella enterica)	5 / 8	LEU A 267 ALA A 265 GLY A 90 LEU A 89 GLY A 296	None	1.32A	2yfxA-2pb0A: undetectable	2yfxA-2pb0A: 22.32
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.	3K9W_A_ACTA170_0 (PHOSPHOPANTETHEINE ADENYLYLTRANSFERASE)	2pb0	ACETYLORNITHINE/SUCC INYLDIAMINOPIMELATE AMINOTRANSFERASE (Salmonella enterica)	3 / 3	SER A 107 GLY A 108 THR A 109	PLP A 555 (-3.6A) PLP A 555 (-3.3A) PLP A 555 ( 3.5A)	0.15A	3k9wA-2pb0A: undetectable	3k9wA-2pb0A: 19.05
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.	3LM8_B_VIBB223_1 (THIAMINE PYROPHOSPHOKINASE)	2pb0	ACETYLORNITHINE/SUCC INYLDIAMINOPIMELATE AMINOTRANSFERASE (Salmonella enterica)	4 / 7	TYR A 241 LEU A 209 LEU A 223 THR A 269	None	1.00A	3lm8B-2pb0A: undetectable 3lm8D-2pb0A: undetectable	3lm8B-2pb0A: 18.01 3lm8D-2pb0A: 18.01
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.	3NRR_A_D16A520_1 (DIHYDROFOLATE REDUCTASE-THYMIDYLAT E SYNTHASE)	2pb0	ACETYLORNITHINE/SUCC INYLDIAMINOPIMELATE AMINOTRANSFERASE (Salmonella enterica)	5 / 12	ALA A 178 ASP A 175 PHE A 208 LEU A 176 LEU A 215	None	1.22A	3nrrA-2pb0A: undetectable	3nrrA-2pb0A: 20.90
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.	3NRR_B_D16B520_1 (DIHYDROFOLATE REDUCTASE-THYMIDYLAT E SYNTHASE)	2pb0	ACETYLORNITHINE/SUCC INYLDIAMINOPIMELATE AMINOTRANSFERASE (Salmonella enterica)	5 / 12	ALA A 178 ASP A 175 PHE A 208 LEU A 176 LEU A 215	None	1.18A	3nrrB-2pb0A: 2.3	3nrrB-2pb0A: 20.90
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.	3T3S_D_9PLD1_1 (CYTOCHROME P450 2A13)	2pb0	ACETYLORNITHINE/SUCC INYLDIAMINOPIMELATE AMINOTRANSFERASE (Salmonella enterica)	4 / 8	PHE A 332 ALA A 324 PHE A 396 ALA A 397	None	0.94A	3t3sD-2pb0A: undetectable	3t3sD-2pb0A: 21.25
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.	4J4V_D_SVRD301_1 (NUCLEOCAPSID PROTEIN)	2pb0	ACETYLORNITHINE/SUCC INYLDIAMINOPIMELATE AMINOTRANSFERASE (Salmonella enterica)	5 / 11	ALA A 362 VAL A 368 MET A 376 PHE A 332 ILE A 325	None	1.14A	4j4vD-2pb0A: undetectable 4j4vE-2pb0A: undetectable	4j4vD-2pb0A: 20.43 4j4vE-2pb0A: 20.43
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.	4KTT_A_SAMA405_1 (S-ADENOSYLMETHIONINE SYNTHASE ISOFORM TYPE-2)	2pb0	ACETYLORNITHINE/SUCC INYLDIAMINOPIMELATE AMINOTRANSFERASE (Salmonella enterica)	5 / 8	ALA A 324 GLN A 323 ASP A 334 ILE A 335 ILE A 342	None	1.26A	4kttB-2pb0A: undetectable	4kttB-2pb0A: 21.10
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.	4QZT_A_RTLA201_1 (RETINOL-BINDING PROTEIN 2)	2pb0	ACETYLORNITHINE/SUCC INYLDIAMINOPIMELATE AMINOTRANSFERASE (Salmonella enterica)	3 / 3	PHE A 239 THR A 284 LEU A 257	None	0.59A	4qztA-2pb0A: undetectable	4qztA-2pb0A: 15.99
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.	5C0O_E_SAME301_0 (TRNA (ADENINE(58)-N(1))-M ETHYLTRANSFERASE TRMI)	2pb0	ACETYLORNITHINE/SUCC INYLDIAMINOPIMELATE AMINOTRANSFERASE (Salmonella enterica)	6 / 12	GLY A 258 GLY A 260 GLY A 57 LEU A 56 ALA A 291 LEU A 257	None EDO A1002 ( 4.6A) None None None None	1.26A	5c0oE-2pb0A: 2.1	5c0oE-2pb0A: 21.40
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.	5C0O_G_SAMG301_0 (TRNA (ADENINE(58)-N(1))-M ETHYLTRANSFERASE TRMI)	2pb0	ACETYLORNITHINE/SUCC INYLDIAMINOPIMELATE AMINOTRANSFERASE (Salmonella enterica)	6 / 12	GLY A 258 GLY A 260 GLY A 57 LEU A 56 ALA A 291 LEU A 257	None EDO A1002 ( 4.6A) None None None None	1.26A	5c0oG-2pb0A: 2.9	5c0oG-2pb0A: 21.40
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.	5IGV_A_ZITA404_1 (MACROLIDE 2'-PHOSPHOTRANSFERAS E II)	2pb0	ACETYLORNITHINE/SUCC INYLDIAMINOPIMELATE AMINOTRANSFERASE (Salmonella enterica)	5 / 12	ILE A 311 GLY A 236 GLU A 385 ALA A 52 ILE A 301	None	1.25A	5igvA-2pb0A: undetectable	5igvA-2pb0A: 21.26
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.	5UBB_A_SAMA301_0 (ALPHA N-TERMINAL PROTEIN METHYLTRANSFERASE 1B)	2pb0	ACETYLORNITHINE/SUCC INYLDIAMINOPIMELATE AMINOTRANSFERASE (Salmonella enterica)	5 / 12	MET A 242 GLY A 233 LEU A 382 HIS A 312 LEU A 340	None	1.21A	5ubbA-2pb0A: 3.6	5ubbA-2pb0A: 19.61
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.	5VKQ_A_PCFA1801_0 (NO MECHANORECEPTOR POTENTIAL C ISOFORM L)	2pb0	ACETYLORNITHINE/SUCC INYLDIAMINOPIMELATE AMINOTRANSFERASE (Salmonella enterica)	4 / 6	ILE A 302 ILE A 94 LEU A 267 PHE A 239	None	1.02A	5vkqA-2pb0A: undetectable 5vkqB-2pb0A: undetectable	5vkqA-2pb0A: 14.50 5vkqB-2pb0A: 14.50
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.	5VKQ_B_PCFB1806_0 (NO MECHANORECEPTOR POTENTIAL C ISOFORM L)	2pb0	ACETYLORNITHINE/SUCC INYLDIAMINOPIMELATE AMINOTRANSFERASE (Salmonella enterica)	4 / 6	ILE A 302 ILE A 94 LEU A 267 PHE A 239	None	1.01A	5vkqB-2pb0A: undetectable 5vkqC-2pb0A: undetectable	5vkqB-2pb0A: 14.50 5vkqC-2pb0A: 14.50
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.	5VKQ_C_PCFC1807_0 (NO MECHANORECEPTOR POTENTIAL C ISOFORM L)	2pb0	ACETYLORNITHINE/SUCC INYLDIAMINOPIMELATE AMINOTRANSFERASE (Salmonella enterica)	4 / 6	ILE A 302 ILE A 94 LEU A 267 PHE A 239	None	1.01A	5vkqC-2pb0A: undetectable 5vkqD-2pb0A: undetectable	5vkqC-2pb0A: 14.50 5vkqD-2pb0A: 14.50
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.	5VKQ_D_PCFD1807_0 (NO MECHANORECEPTOR POTENTIAL C ISOFORM L)	2pb0	ACETYLORNITHINE/SUCC INYLDIAMINOPIMELATE AMINOTRANSFERASE (Salmonella enterica)	4 / 6	ILE A 302 ILE A 94 LEU A 267 PHE A 239	None	1.00A	5vkqA-2pb0A: undetectable 5vkqD-2pb0A: undetectable	5vkqA-2pb0A: 14.50 5vkqD-2pb0A: 14.50
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.	6AUU_A_H4BA802_1 (NITRIC OXIDE SYNTHASE, BRAIN)	2pb0	ACETYLORNITHINE/SUCC INYLDIAMINOPIMELATE AMINOTRANSFERASE (Salmonella enterica)	4 / 7	VAL A 366 TRP A 37 PHE A 26 GLU A 43	None	1.44A	6auuA-2pb0A: undetectable 6auuB-2pb0A: undetectable	6auuA-2pb0A: 10.48 6auuB-2pb0A: 10.48
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.	6AYC_A_1YNA502_2 (PROTEIN CYP51)	2pb0	ACETYLORNITHINE/SUCC INYLDIAMINOPIMELATE AMINOTRANSFERASE (Salmonella enterica)	4 / 7	VAL A 171 PRO A 248 LEU A 251 LEU A 223	None	1.19A	6aycA-2pb0A: undetectable	6aycA-2pb0A: 11.41
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.	6BQG_A_ERMA1201_1 (5-HYDROXYTRYPTAMINE RECEPTOR 2C,SOLUBLE CYTOCHROME B562)	2pb0	ACETYLORNITHINE/SUCC INYLDIAMINOPIMELATE AMINOTRANSFERASE (Salmonella enterica)	5 / 12	VAL A 228 GLY A 231 ALA A 240 GLU A 113 VAL A 191	PLP A 555 (-4.3A) None None None None	1.11A	6bqgA-2pb0A: undetectable	6bqgA-2pb0A: 9.20
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.	6EXI_D_ADND503_0 (ADENOSYLHOMOCYSTEINA SE)	2pb0	ACETYLORNITHINE/SUCC INYLDIAMINOPIMELATE AMINOTRANSFERASE (Salmonella enterica)	5 / 12	GLY A 152 GLY A 143 VAL A 191 ASP A 226 ILE A 168	None PLP A 555 ( 4.1A) None PLP A 555 (-2.9A) None	1.11A	6exiC-2pb0A: undetectable 6exiD-2pb0A: undetectable	6exiC-2pb0A: 12.92 6exiD-2pb0A: 12.92

[["DrReposER ID","Desc.","Hit PDB","Hit molecule","Hit organism","Res. no.","Interface","HETATM","RMSD","Z-score","Seq ID"],["1FIQ_C_SALC1335_1","XANTHINE OXIDASE","2pb0","ACETYLORNITHINE\/SUCCINYLDIAMINOPIMELATE AMINOTRANSFERASE","Salmonella enterica",4,"LEU A 251;PHE A  98;VAL A 102;LEU A  93","None","0.93A","1fiqC-2pb0A:undetectable","1fiqC-2pb0A:19.56"],["1ICR_A_NIOA604_1","OXYGEN-INSENSITIVE NAD(P)H NITROREDUCTASE;OXYGEN-INSENSITIVE NAD(P)H NITROREDUCTASE","2pb0","ACETYLORNITHINE\/SUCCINYLDIAMINOPIMELATE AMINOTRANSFERASE","Salmonella enterica",4,"THR A 205;PHE A 208;GLU A 207;GLY A 211","EDO A1004 ( 4.4A);None;None;None","1.16A","1icrA-2pb0A:undetectable;1icrB-2pb0A:undetectable","1icrA-2pb0A:19.34;1icrB-2pb0A:19.34"],["1ICR_B_NIOB602_1","OXYGEN-INSENSITIVE NAD(P)H NITROREDUCTASE;OXYGEN-INSENSITIVE NAD(P)H NITROREDUCTASE","2pb0","ACETYLORNITHINE\/SUCCINYLDIAMINOPIMELATE AMINOTRANSFERASE","Salmonella enterica",4,"GLU A 207;GLY A 211;THR A 205;PHE A 208","None;None;EDO A1004 ( 4.4A);None","1.19A","1icrA-2pb0A:undetectable;1icrB-2pb0A:undetectable","1icrA-2pb0A:19.34;1icrB-2pb0A:19.34"],["1ICU_B_NIOB219_1","OXYGEN-INSENSITIVE NAD(P)H NITROREDUCTASE;OXYGEN-INSENSITIVE NAD(P)H NITROREDUCTASE","2pb0","ACETYLORNITHINE\/SUCCINYLDIAMINOPIMELATE AMINOTRANSFERASE","Salmonella enterica",4,"GLU A 207;GLY A 211;THR A 205;PHE A 208","None;None;EDO A1004 ( 4.4A);None","1.14A","1icuA-2pb0A:undetectable;1icuB-2pb0A:undetectable","1icuA-2pb0A:19.34;1icuB-2pb0A:19.34"],["1ICV_C_NIOC708_1","OXYGEN-INSENSITIVE NAD(P)H NITROREDUCTASE;OXYGEN-INSENSITIVE NAD(P)H NITROREDUCTASE","2pb0","ACETYLORNITHINE\/SUCCINYLDIAMINOPIMELATE AMINOTRANSFERASE","Salmonella enterica",4,"THR A 205;PHE A 208;GLU A 207;GLY A 211","EDO A1004 ( 4.4A);None;None;None","1.20A","1icvC-2pb0A:undetectable;1icvD-2pb0A:undetectable","1icvC-2pb0A:19.34;1icvD-2pb0A:19.34"],["1ICV_D_NIOD706_1","OXYGEN-INSENSITIVE NAD(P)H NITROREDUCTASE;OXYGEN-INSENSITIVE NAD(P)H NITROREDUCTASE","2pb0","ACETYLORNITHINE\/SUCCINYLDIAMINOPIMELATE AMINOTRANSFERASE","Salmonella enterica",4,"GLU A 207;GLY A 211;THR A 205;PHE A 208","None;None;EDO A1004 ( 4.4A);None","1.16A","1icvC-2pb0A:undetectable;1icvD-2pb0A:undetectable","1icvC-2pb0A:19.34;1icvD-2pb0A:19.34"],["1JHV_A_NIOA991_1","NICOTINATE MONONUCLEOTIDE:5,6-DIMETHYLBENZIMIDAZOLE PHOSPHORIBOSYLTRANSFERASE","2pb0","ACETYLORNITHINE\/SUCCINYLDIAMINOPIMELATE AMINOTRANSFERASE","Salmonella enterica",4,"GLY A 199;GLY A 337;LEU A 341;GLY A 343","None","0.77A","1jhvA-2pb0A:undetectable","1jhvA-2pb0A:22.17"],["1KQB_A_BEZA524_0","OXYGEN-INSENSITIVE NAD(P)H NITROREDUCTASE","2pb0","ACETYLORNITHINE\/SUCCINYLDIAMINOPIMELATE AMINOTRANSFERASE","Salmonella enterica",4,"THR A 205;PHE A 208;GLU A 207;GLY A 211","EDO A1004 ( 4.4A);None;None;None","1.11A","1kqbA-2pb0A:undetectable;1kqbB-2pb0A:undetectable","1kqbA-2pb0A:20.15;1kqbB-2pb0A:20.15"],["1KQB_B_BEZB525_0","OXYGEN-INSENSITIVE NAD(P)H NITROREDUCTASE","2pb0","ACETYLORNITHINE\/SUCCINYLDIAMINOPIMELATE AMINOTRANSFERASE","Salmonella enterica",4,"GLU A 207;GLY A 211;THR A 205;PHE A 208","None;None;EDO A1004 ( 4.4A);None","1.16A","1kqbA-2pb0A:undetectable;1kqbB-2pb0A:undetectable","1kqbA-2pb0A:20.15;1kqbB-2pb0A:20.15"],["1KQB_C_BEZC522_0","OXYGEN-INSENSITIVE NAD(P)H NITROREDUCTASE","2pb0","ACETYLORNITHINE\/SUCCINYLDIAMINOPIMELATE AMINOTRANSFERASE","Salmonella enterica",4,"THR A 205;PHE A 208;GLU A 207;GLY A 211","EDO A1004 ( 4.4A);None;None;None","1.11A","1kqbC-2pb0A:undetectable;1kqbD-2pb0A:undetectable","1kqbC-2pb0A:20.15;1kqbD-2pb0A:20.15"],["1KQB_D_BEZD523_0","OXYGEN-INSENSITIVE NAD(P)H NITROREDUCTASE","2pb0","ACETYLORNITHINE\/SUCCINYLDIAMINOPIMELATE AMINOTRANSFERASE","Salmonella enterica",4,"GLU A 207;GLY A 211;THR A 205;PHE A 208","None;None;EDO A1004 ( 4.4A);None","1.16A","1kqbC-2pb0A:undetectable;1kqbD-2pb0A:undetectable","1kqbC-2pb0A:20.15;1kqbD-2pb0A:20.15"],["1LIK_A_ADNA799_1","ADENOSINE KINASE","2pb0","ACETYLORNITHINE\/SUCCINYLDIAMINOPIMELATE AMINOTRANSFERASE","Salmonella enterica",5,"THR A 148;VAL A 151;VAL A 191;ALA A 111;ALA A 115","None","1.03A","1likA-2pb0A:undetectable","1likA-2pb0A:20.59"],["1RUK_H_BEZH601_0","IMMUNOGLOBULIN IGG2A, HEAVY CHAIN;IMMUNOGLOBULIN IGG2A, LIGHT CHAIN","2pb0","ACETYLORNITHINE\/SUCCINYLDIAMINOPIMELATE AMINOTRANSFERASE","Salmonella enterica",4,"ALA A  96;LEU A  93;GLY A  90;GLY A 296","None","0.85A","1rukH-2pb0A:undetectable;1rukL-2pb0A:undetectable","1rukH-2pb0A:20.11;1rukL-2pb0A:20.84"],["1WG8_A_SAMA3142_0","PREDICTED S-ADENOSYLMETHIONINE-DEPENDENT METHYLTRANSFERASE","2pb0","ACETYLORNITHINE\/SUCCINYLDIAMINOPIMELATE AMINOTRANSFERASE","Salmonella enterica",5,"GLY A 200;GLY A 199;GLY A 197;ASP A 374;PHE A 332","None","1.13A","1wg8A-2pb0A:3.3","1wg8A-2pb0A:21.58"],["1WG8_B_SAMB3141_0","PREDICTED S-ADENOSYLMETHIONINE-DEPENDENT METHYLTRANSFERASE","2pb0","ACETYLORNITHINE\/SUCCINYLDIAMINOPIMELATE AMINOTRANSFERASE","Salmonella enterica",5,"GLY A 200;GLY A 199;GLY A 197;ASP A 374;PHE A 332","None","1.16A","1wg8B-2pb0A:3.0","1wg8B-2pb0A:21.58"],["1XDK_B_9CRB600_1","RETINOIC ACID RECEPTOR, BETA","2pb0","ACETYLORNITHINE\/SUCCINYLDIAMINOPIMELATE AMINOTRANSFERASE","Salmonella enterica",5,"PHE A 378;LEU A 346;ILE A 331;ILE A 325;PHE A 396","None","1.16A","1xdkB-2pb0A:undetectable","1xdkB-2pb0A:19.91"],["1YAJ_G_BEZG3385_0","CES1 PROTEIN","2pb0","ACETYLORNITHINE\/SUCCINYLDIAMINOPIMELATE AMINOTRANSFERASE","Salmonella enterica",3,"SER A 253;VAL A 102;LEU A 267","None","0.67A","1yajG-2pb0A:undetectable","1yajG-2pb0A:23.87"],["2C6N_B_LPRB705_2","ANGIOTENSIN-CONVERTING ENZYME, SOMATIC ISOFORM","2pb0","ACETYLORNITHINE\/SUCCINYLDIAMINOPIMELATE AMINOTRANSFERASE","Salmonella enterica",3,"ALA A 115;THR A 252;PHE A 147","None","0.68A","2c6nB-2pb0A:undetectable","2c6nB-2pb0A:19.97"],["2YFX_A_VGHA9000_1","TYROSINE-PROTEIN KINASE RECEPTOR","2pb0","ACETYLORNITHINE\/SUCCINYLDIAMINOPIMELATE AMINOTRANSFERASE","Salmonella enterica",5,"LEU A 267;ALA A 265;GLY A  90;LEU A  89;GLY A 296","None","1.32A","2yfxA-2pb0A:undetectable","2yfxA-2pb0A:22.32"],["3K9W_A_ACTA170_0","PHOSPHOPANTETHEINE ADENYLYLTRANSFERASE","2pb0","ACETYLORNITHINE\/SUCCINYLDIAMINOPIMELATE AMINOTRANSFERASE","Salmonella enterica",3,"SER A 107;GLY A 108;THR A 109","PLP A 555 (-3.6A);PLP A 555 (-3.3A);PLP A 555 ( 3.5A)","0.15A","3k9wA-2pb0A:undetectable","3k9wA-2pb0A:19.05"],["3LM8_B_VIBB223_1","THIAMINE PYROPHOSPHOKINASE;THIAMINE PYROPHOSPHOKINASE","2pb0","ACETYLORNITHINE\/SUCCINYLDIAMINOPIMELATE AMINOTRANSFERASE","Salmonella enterica",4,"TYR A 241;LEU A 209;LEU A 223;THR A 269","None","1.00A","3lm8B-2pb0A:undetectable;3lm8D-2pb0A:undetectable","3lm8B-2pb0A:18.01;3lm8D-2pb0A:18.01"],["3NRR_A_D16A520_1","DIHYDROFOLATE REDUCTASE-THYMIDYLATE SYNTHASE","2pb0","ACETYLORNITHINE\/SUCCINYLDIAMINOPIMELATE AMINOTRANSFERASE","Salmonella enterica",5,"ALA A 178;ASP A 175;PHE A 208;LEU A 176;LEU A 215","None","1.22A","3nrrA-2pb0A:undetectable","3nrrA-2pb0A:20.90"],["3NRR_B_D16B520_1","DIHYDROFOLATE REDUCTASE-THYMIDYLATE SYNTHASE","2pb0","ACETYLORNITHINE\/SUCCINYLDIAMINOPIMELATE AMINOTRANSFERASE","Salmonella enterica",5,"ALA A 178;ASP A 175;PHE A 208;LEU A 176;LEU A 215","None","1.18A","3nrrB-2pb0A:2.3","3nrrB-2pb0A:20.90"],["3T3S_D_9PLD1_1","CYTOCHROME P450 2A13","2pb0","ACETYLORNITHINE\/SUCCINYLDIAMINOPIMELATE AMINOTRANSFERASE","Salmonella enterica",4,"PHE A 332;ALA A 324;PHE A 396;ALA A 397","None","0.94A","3t3sD-2pb0A:undetectable","3t3sD-2pb0A:21.25"],["4J4V_D_SVRD301_1","NUCLEOCAPSID PROTEIN;NUCLEOCAPSID PROTEIN","2pb0","ACETYLORNITHINE\/SUCCINYLDIAMINOPIMELATE AMINOTRANSFERASE","Salmonella enterica",5,"ALA A 362;VAL A 368;MET A 376;PHE A 332;ILE A 325","None","1.14A","4j4vD-2pb0A:undetectable;4j4vE-2pb0A:undetectable","4j4vD-2pb0A:20.43;4j4vE-2pb0A:20.43"],["4KTT_A_SAMA405_1","S-ADENOSYLMETHIONINE SYNTHASE ISOFORM TYPE-2","2pb0","ACETYLORNITHINE\/SUCCINYLDIAMINOPIMELATE AMINOTRANSFERASE","Salmonella enterica",5,"ALA A 324;GLN A 323;ASP A 334;ILE A 335;ILE A 342","None","1.26A","4kttB-2pb0A:undetectable","4kttB-2pb0A:21.10"],["4QZT_A_RTLA201_1","RETINOL-BINDING PROTEIN 2","2pb0","ACETYLORNITHINE\/SUCCINYLDIAMINOPIMELATE AMINOTRANSFERASE","Salmonella enterica",3,"PHE A 239;THR A 284;LEU A 257","None","0.59A","4qztA-2pb0A:undetectable","4qztA-2pb0A:15.99"],["5C0O_E_SAME301_0","TRNA (ADENINE(58)-N(1))-METHYLTRANSFERASE TRMI","2pb0","ACETYLORNITHINE\/SUCCINYLDIAMINOPIMELATE AMINOTRANSFERASE","Salmonella enterica",6,"GLY A 258;GLY A 260;GLY A  57;LEU A  56;ALA A 291;LEU A 257","None;EDO A1002 ( 4.6A);None;None;None;None","1.26A","5c0oE-2pb0A:2.1","5c0oE-2pb0A:21.40"],["5C0O_G_SAMG301_0","TRNA (ADENINE(58)-N(1))-METHYLTRANSFERASE TRMI","2pb0","ACETYLORNITHINE\/SUCCINYLDIAMINOPIMELATE AMINOTRANSFERASE","Salmonella enterica",6,"GLY A 258;GLY A 260;GLY A  57;LEU A  56;ALA A 291;LEU A 257","None;EDO A1002 ( 4.6A);None;None;None;None","1.26A","5c0oG-2pb0A:2.9","5c0oG-2pb0A:21.40"],["5IGV_A_ZITA404_1","MACROLIDE 2'-PHOSPHOTRANSFERASE II","2pb0","ACETYLORNITHINE\/SUCCINYLDIAMINOPIMELATE AMINOTRANSFERASE","Salmonella enterica",5,"ILE A 311;GLY A 236;GLU A 385;ALA A  52;ILE A 301","None","1.25A","5igvA-2pb0A:undetectable","5igvA-2pb0A:21.26"],["5UBB_A_SAMA301_0","ALPHA N-TERMINAL PROTEIN METHYLTRANSFERASE 1B","2pb0","ACETYLORNITHINE\/SUCCINYLDIAMINOPIMELATE AMINOTRANSFERASE","Salmonella enterica",5,"MET A 242;GLY A 233;LEU A 382;HIS A 312;LEU A 340","None","1.21A","5ubbA-2pb0A:3.6","5ubbA-2pb0A:19.61"],["5VKQ_A_PCFA1801_0","NO MECHANORECEPTOR POTENTIAL C ISOFORM L","2pb0","ACETYLORNITHINE\/SUCCINYLDIAMINOPIMELATE AMINOTRANSFERASE","Salmonella enterica",4,"ILE A 302;ILE A  94;LEU A 267;PHE A 239","None","1.02A","5vkqA-2pb0A:undetectable;5vkqB-2pb0A:undetectable","5vkqA-2pb0A:14.50;5vkqB-2pb0A:14.50"],["5VKQ_B_PCFB1806_0","NO MECHANORECEPTOR POTENTIAL C ISOFORM L","2pb0","ACETYLORNITHINE\/SUCCINYLDIAMINOPIMELATE AMINOTRANSFERASE","Salmonella enterica",4,"ILE A 302;ILE A  94;LEU A 267;PHE A 239","None","1.01A","5vkqB-2pb0A:undetectable;5vkqC-2pb0A:undetectable","5vkqB-2pb0A:14.50;5vkqC-2pb0A:14.50"],["5VKQ_C_PCFC1807_0","NO MECHANORECEPTOR POTENTIAL C ISOFORM L","2pb0","ACETYLORNITHINE\/SUCCINYLDIAMINOPIMELATE AMINOTRANSFERASE","Salmonella enterica",4,"ILE A 302;ILE A  94;LEU A 267;PHE A 239","None","1.01A","5vkqC-2pb0A:undetectable;5vkqD-2pb0A:undetectable","5vkqC-2pb0A:14.50;5vkqD-2pb0A:14.50"],["5VKQ_D_PCFD1807_0","NO MECHANORECEPTOR POTENTIAL C ISOFORM L","2pb0","ACETYLORNITHINE\/SUCCINYLDIAMINOPIMELATE AMINOTRANSFERASE","Salmonella enterica",4,"ILE A 302;ILE A  94;LEU A 267;PHE A 239","None","1.00A","5vkqA-2pb0A:undetectable;5vkqD-2pb0A:undetectable","5vkqA-2pb0A:14.50;5vkqD-2pb0A:14.50"],["6AUU_A_H4BA802_1","NITRIC OXIDE SYNTHASE, BRAIN;NITRIC OXIDE SYNTHASE, BRAIN","2pb0","ACETYLORNITHINE\/SUCCINYLDIAMINOPIMELATE AMINOTRANSFERASE","Salmonella enterica",4,"VAL A 366;TRP A  37;PHE A  26;GLU A  43","None","1.44A","6auuA-2pb0A:undetectable;6auuB-2pb0A:undetectable","6auuA-2pb0A:10.48;6auuB-2pb0A:10.48"],["6AYC_A_1YNA502_2","PROTEIN CYP51","2pb0","ACETYLORNITHINE\/SUCCINYLDIAMINOPIMELATE AMINOTRANSFERASE","Salmonella enterica",4,"VAL A 171;PRO A 248;LEU A 251;LEU A 223","None","1.19A","6aycA-2pb0A:undetectable","6aycA-2pb0A:11.41"],["6BQG_A_ERMA1201_1","5-HYDROXYTRYPTAMINE RECEPTOR 2C,SOLUBLE CYTOCHROME B562","2pb0","ACETYLORNITHINE\/SUCCINYLDIAMINOPIMELATE AMINOTRANSFERASE","Salmonella enterica",5,"VAL A 228;GLY A 231;ALA A 240;GLU A 113;VAL A 191","PLP A 555 (-4.3A);None;None;None;None","1.11A","6bqgA-2pb0A:undetectable","6bqgA-2pb0A:9.20"],["6EXI_D_ADND503_0","ADENOSYLHOMOCYSTEINASE","2pb0","ACETYLORNITHINE\/SUCCINYLDIAMINOPIMELATE AMINOTRANSFERASE","Salmonella enterica",5,"GLY A 152;GLY A 143;VAL A 191;ASP A 226;ILE A 168","None;PLP A 555 ( 4.1A);None;PLP A 555 (-2.9A);None","1.11A","6exiC-2pb0A:undetectable;6exiD-2pb0A:undetectable","6exiC-2pb0A:12.92;6exiD-2pb0A:12.92"]]