SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3v4c'

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.	1C9S_J_TRPJ81_0 (TRP RNA-BINDING ATTENUATION PROTEIN)	3v4c	ALDEHYDE DEHYDROGENASE (NADP+) (Sinorhizobium meliloti)	4 / 8	SER A 163 GLY A 86 THR A 190 ILE A 82	None	0.76A	1c9sI-3v4cA: undetectable 1c9sJ-3v4cA: undetectable	1c9sI-3v4cA: 10.56 1c9sJ-3v4cA: 10.56
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.	1C9S_U_TRPU81_0 (TRP RNA-BINDING ATTENUATION PROTEIN)	3v4c	ALDEHYDE DEHYDROGENASE (NADP+) (Sinorhizobium meliloti)	4 / 8	GLY A 86 THR A 190 ILE A 82 SER A 163	None	0.80A	1c9sU-3v4cA: undetectable 1c9sV-3v4cA: undetectable	1c9sU-3v4cA: 10.56 1c9sV-3v4cA: 10.56
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.	1D4F_B_ADNB602_2 (S-ADENOSYLHOMOCYSTEI NE HYDROLASE)	3v4c	ALDEHYDE DEHYDROGENASE (NADP+) (Sinorhizobium meliloti)	4 / 5	THR A 164 GLU A 89 THR A 90 HIS A 184	None	1.42A	1d4fB-3v4cA: 4.5	1d4fB-3v4cA: 20.22
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.	1GTN_A_TRPA81_0 (TRP RNA-BINDING ATTENUATION PROTEIN)	3v4c	ALDEHYDE DEHYDROGENASE (NADP+) (Sinorhizobium meliloti)	4 / 7	GLY A 86 THR A 190 ILE A 82 SER A 163	None	0.71A	1gtnA-3v4cA: undetectable 1gtnK-3v4cA: undetectable	1gtnA-3v4cA: 10.56 1gtnK-3v4cA: 10.56
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.	1GTN_E_TRPE81_0 (TRP RNA-BINDING ATTENUATION PROTEIN)	3v4c	ALDEHYDE DEHYDROGENASE (NADP+) (Sinorhizobium meliloti)	4 / 6	SER A 163 GLY A 86 THR A 190 ILE A 82	None	0.73A	1gtnD-3v4cA: undetectable 1gtnE-3v4cA: undetectable	1gtnD-3v4cA: 10.56 1gtnE-3v4cA: 10.56
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.	1GTN_F_TRPF81_0 (TRP RNA-BINDING ATTENUATION PROTEIN)	3v4c	ALDEHYDE DEHYDROGENASE (NADP+) (Sinorhizobium meliloti)	4 / 8	SER A 163 GLY A 86 THR A 190 ILE A 82	None	0.76A	1gtnE-3v4cA: undetectable 1gtnF-3v4cA: undetectable	1gtnE-3v4cA: 10.56 1gtnF-3v4cA: 10.56
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.	1GTN_G_TRPG81_0 (TRP RNA-BINDING ATTENUATION PROTEIN)	3v4c	ALDEHYDE DEHYDROGENASE (NADP+) (Sinorhizobium meliloti)	4 / 7	SER A 163 GLY A 86 THR A 190 ILE A 82	None	0.77A	1gtnF-3v4cA: undetectable 1gtnG-3v4cA: undetectable	1gtnF-3v4cA: 10.56 1gtnG-3v4cA: 10.56
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.	1GTN_J_TRPJ81_0 (TRP RNA-BINDING ATTENUATION PROTEIN)	3v4c	ALDEHYDE DEHYDROGENASE (NADP+) (Sinorhizobium meliloti)	4 / 8	SER A 163 GLY A 86 THR A 190 ILE A 82	None	0.72A	1gtnI-3v4cA: undetectable 1gtnJ-3v4cA: undetectable	1gtnI-3v4cA: 10.56 1gtnJ-3v4cA: 10.56
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.	1GTN_K_TRPK81_0 (TRP RNA-BINDING ATTENUATION PROTEIN)	3v4c	ALDEHYDE DEHYDROGENASE (NADP+) (Sinorhizobium meliloti)	4 / 7	SER A 163 GLY A 86 THR A 190 ILE A 82	None	0.74A	1gtnJ-3v4cA: undetectable 1gtnK-3v4cA: undetectable	1gtnJ-3v4cA: 10.56 1gtnK-3v4cA: 10.56
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.	1UTD_I_TRPI81_0 (TRANSCRIPTION ATTENUATION PROTEIN MTRB)	3v4c	ALDEHYDE DEHYDROGENASE (NADP+) (Sinorhizobium meliloti)	4 / 8	GLY A 86 THR A 190 ILE A 82 SER A 163	None	0.78A	1utdI-3v4cA: undetectable 1utdJ-3v4cA: undetectable	1utdI-3v4cA: 10.56 1utdJ-3v4cA: 10.56
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.	1V8B_A_ADNA502_1 (ADENOSYLHOMOCYSTEINA SE)	3v4c	ALDEHYDE DEHYDROGENASE (NADP+) (Sinorhizobium meliloti)	5 / 12	LEU A 446 THR A 452 GLY A 463 HIS A 462 MET A 460	None	1.33A	1v8bA-3v4cA: undetectable	1v8bA-3v4cA: 19.32
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.	1V8B_B_ADNB1502_1 (ADENOSYLHOMOCYSTEINA SE)	3v4c	ALDEHYDE DEHYDROGENASE (NADP+) (Sinorhizobium meliloti)	5 / 12	LEU A 446 THR A 452 GLY A 463 HIS A 462 MET A 460	None	1.30A	1v8bB-3v4cA: undetectable	1v8bB-3v4cA: 19.32
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.	1V8B_D_ADND3502_1 (ADENOSYLHOMOCYSTEINA SE)	3v4c	ALDEHYDE DEHYDROGENASE (NADP+) (Sinorhizobium meliloti)	5 / 12	LEU A 446 THR A 452 GLY A 463 HIS A 462 MET A 460	None	1.30A	1v8bD-3v4cA: 2.5	1v8bD-3v4cA: 19.32
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.	2BXG_A_IBPA2001_1 (SERUM ALBUMIN)	3v4c	ALDEHYDE DEHYDROGENASE (NADP+) (Sinorhizobium meliloti)	5 / 11	VAL A 147 GLY A 148 ALA A 234 ARG A 484 SER A 481	None	1.19A	2bxgA-3v4cA: 3.6	2bxgA-3v4cA: 22.22
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.	2BXM_A_IMNA2002_1 (SERUM ALBUMIN)	3v4c	ALDEHYDE DEHYDROGENASE (NADP+) (Sinorhizobium meliloti)	5 / 11	ARG A 96 LEU A 160 ILE A 75 ARG A 103 GLY A 106	None None None PE4 A 506 (-4.5A) PE4 A 506 ( 4.1A)	1.21A	2bxmA-3v4cA: 4.7	2bxmA-3v4cA: 22.22
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.	2HJH_B_NCAB901_0 (NAD-DEPENDENT HISTONE DEACETYLASE SIR2)	3v4c	ALDEHYDE DEHYDROGENASE (NADP+) (Sinorhizobium meliloti)	4 / 5	ILE A 232 PRO A 149 PHE A 485 VAL A 179	None	1.24A	2hjhB-3v4cA: 5.1	2hjhB-3v4cA: 17.76
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.	2Q64_B_1UNB1001_2 (PROTEASE RETROPEPSIN)	3v4c	ALDEHYDE DEHYDROGENASE (NADP+) (Sinorhizobium meliloti)	3 / 3	ARG A 103 THR A 475 VAL A 477	PE4 A 506 (-4.5A) None None	0.96A	2q64A-3v4cA: undetectable	2q64A-3v4cA: 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.	2V0M_B_KLNB1498_1 (CYTOCHROME P450 3A4)	3v4c	ALDEHYDE DEHYDROGENASE (NADP+) (Sinorhizobium meliloti)	5 / 9	PHE A 349 ARG A 399 ALA A 320 GLY A 395 LEU A 372	None	0.97A	2v0mB-3v4cA: undetectable	2v0mB-3v4cA: 22.14
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.	2VDY_A_HCYA1384_1 (CORTICOSTEROID-BINDI NG GLOBULIN)	3v4c	ALDEHYDE DEHYDROGENASE (NADP+) (Sinorhizobium meliloti)	5 / 12	PHE A 237 ARG A 220 SER A 240 PHE A 153 HIS A 184	None	1.46A	2vdyA-3v4cA: undetectable	2vdyA-3v4cA: 22.51
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.	2VL2_A_BEZA1162_0 (PEROXIREDOXIN-5)	3v4c	ALDEHYDE DEHYDROGENASE (NADP+) (Sinorhizobium meliloti)	5 / 10	THR A 169 GLY A 166 LEU A 214 PHE A 212 GLY A 191	None	1.49A	2vl2A-3v4cA: undetectable 2vl2C-3v4cA: 3.1	2vl2A-3v4cA: 18.04 2vl2C-3v4cA: 18.04
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.	2XCT_G_CPFG1020_1 (DNA GYRASE SUBUNIT B, DNA GYRASE SUBUNIT A)	3v4c	ALDEHYDE DEHYDROGENASE (NADP+) (Sinorhizobium meliloti)	3 / 3	ARG A 245 GLY A 244 SER A 476	None	0.57A	2xctB-3v4cA: 2.7	2xctB-3v4cA: 22.54
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.	3BOG_C_DHIC8_0 (6.5 KDA GLYCINE-RICH ANTIFREEZE PROTEIN)	3v4c	ALDEHYDE DEHYDROGENASE (NADP+) (Sinorhizobium meliloti)	3 / 3	SER A 266 GLY A 415 GLY A 464	None	0.51A	3bogA-3v4cA: undetectable 3bogC-3v4cA: undetectable	3bogA-3v4cA: undetectable 3bogC-3v4cA: undetectable
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.	3F8F_A_DM1A127_1 (TRANSCRIPTIONAL REGULATOR, PADR-LIKE FAMILY)	3v4c	ALDEHYDE DEHYDROGENASE (NADP+) (Sinorhizobium meliloti)	5 / 10	MET A 270 ALA A 306 VAL A 397 ALA A 314 TRP A 288	None	1.50A	3f8fA-3v4cA: undetectable 3f8fB-3v4cA: undetectable	3f8fA-3v4cA: 12.12 3f8fB-3v4cA: 12.12
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.	3G1U_D_ADND438_1 (ADENOSYLHOMOCYSTEINA SE)	3v4c	ALDEHYDE DEHYDROGENASE (NADP+) (Sinorhizobium meliloti)	5 / 12	LEU A 446 THR A 452 GLY A 463 HIS A 462 MET A 460	None	1.29A	3g1uD-3v4cA: 2.1	3g1uD-3v4cA: 21.38
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.	3P5N_A_RBFA190_1 (RIBOFLAVIN UPTAKE PROTEIN)	3v4c	ALDEHYDE DEHYDROGENASE (NADP+) (Sinorhizobium meliloti)	5 / 12	LEU A 110 GLY A 167 ALA A 170 ALA A 174 LEU A 68	None	1.14A	3p5nA-3v4cA: undetectable	3p5nA-3v4cA: 16.37
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.	3P5N_B_RBFB190_1 (RIBOFLAVIN UPTAKE PROTEIN)	3v4c	ALDEHYDE DEHYDROGENASE (NADP+) (Sinorhizobium meliloti)	5 / 12	LEU A 110 GLY A 167 ALA A 170 ALA A 174 LEU A 68	None	1.13A	3p5nB-3v4cA: undetectable	3p5nB-3v4cA: 16.37
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.	3TEG_A_DAHA416_1 (PHENYLALANYL-TRNA SYNTHETASE, MITOCHONDRIAL)	3v4c	ALDEHYDE DEHYDROGENASE (NADP+) (Sinorhizobium meliloti)	5 / 12	SER A 163 THR A 90 GLY A 189 GLY A 86 GLY A 191	None	1.16A	3tegA-3v4cA: undetectable	3tegA-3v4cA: 22.20
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.	4DUB_B_LDPB501_1 (CYTOCHROME P450 BM3 VARIANT 9D7)	3v4c	ALDEHYDE DEHYDROGENASE (NADP+) (Sinorhizobium meliloti)	4 / 6	ALA A 246 GLY A 223 LEU A 250 VAL A 227	None	0.88A	4dubB-3v4cA: undetectable	4dubB-3v4cA: 21.97
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.	4J7X_A_SASA806_1 (SEPIAPTERIN REDUCTASE)	3v4c	ALDEHYDE DEHYDROGENASE (NADP+) (Sinorhizobium meliloti)	5 / 12	SER A 363 TYR A 342 GLN A 331 ALA A 296 GLY A 91	None	1.48A	4j7xA-3v4cA: undetectable	4j7xA-3v4cA: 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.	4XE3_B_CL6B502_1 (CYTOCHROME P-450)	3v4c	ALDEHYDE DEHYDROGENASE (NADP+) (Sinorhizobium meliloti)	4 / 5	LEU A 108 ALA A 197 VAL A 211 ILE A 202	None	0.97A	4xe3B-3v4cA: undetectable	4xe3B-3v4cA: 22.90
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.	5BPH_A_ACTA403_0 (D-ALANINE--D-ALANINE LIGASE)	3v4c	ALDEHYDE DEHYDROGENASE (NADP+) (Sinorhizobium meliloti)	4 / 6	TYR A 466 GLY A 243 SER A 240 LEU A 264	None	1.27A	5bphA-3v4cA: 3.6	5bphA-3v4cA: 20.57
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.	5BPH_C_ACTC403_0 (D-ALANINE--D-ALANINE LIGASE)	3v4c	ALDEHYDE DEHYDROGENASE (NADP+) (Sinorhizobium meliloti)	4 / 4	TYR A 466 GLY A 243 SER A 240 LEU A 264	None	1.27A	5bphC-3v4cA: 3.6	5bphC-3v4cA: 20.57
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.	5DZK_R_BEZR801_1 (ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 2 BEZ-LEU-LEU)	3v4c	ALDEHYDE DEHYDROGENASE (NADP+) (Sinorhizobium meliloti)	4 / 8	ALA A 289 PRO A 370 LEU A 372 LEU A 359	None	1.11A	5dzkd-3v4cA: 3.1 5dzkr-3v4cA: undetectable	5dzkd-3v4cA: 19.92 5dzkr-3v4cA: 0.68
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.	5DZK_T_BEZT801_1 (ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 2 BEZ-LEU-LEU)	3v4c	ALDEHYDE DEHYDROGENASE (NADP+) (Sinorhizobium meliloti)	4 / 8	ALA A 289 PRO A 370 LEU A 372 LEU A 359	None	0.86A	5dzkF-3v4cA: 3.0 5dzkT-3v4cA: undetectable	5dzkF-3v4cA: 19.92 5dzkT-3v4cA: 0.68
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.	5M5K_B_ADNB502_1 (ADENOSYLHOMOCYSTEINA SE)	3v4c	ALDEHYDE DEHYDROGENASE (NADP+) (Sinorhizobium meliloti)	5 / 12	LEU A 446 THR A 452 GLY A 463 HIS A 462 MET A 460	None	1.30A	5m5kB-3v4cA: undetectable	5m5kB-3v4cA: 23.53
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.	5M66_A_ADNA502_1 (ADENOSYLHOMOCYSTEINA SE)	3v4c	ALDEHYDE DEHYDROGENASE (NADP+) (Sinorhizobium meliloti)	5 / 12	LEU A 446 THR A 452 GLY A 463 HIS A 462 MET A 460	None	1.30A	5m66A-3v4cA: 2.2	5m66A-3v4cA: 23.53
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.	5PBE_A_TYLA2001_1 (BROMODOMAIN ADJACENT TO ZINC FINGER DOMAIN PROTEIN 2B)	3v4c	ALDEHYDE DEHYDROGENASE (NADP+) (Sinorhizobium meliloti)	4 / 6	VAL A 211 VAL A 207 TYR A 56 ILE A 71	None	0.88A	5pbeA-3v4cA: 2.5	5pbeA-3v4cA: 15.73
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.	5TOA_B_ESTB601_1 (ESTROGEN RECEPTOR BETA)	3v4c	ALDEHYDE DEHYDROGENASE (NADP+) (Sinorhizobium meliloti)	5 / 12	MET A 406 ILE A 421 LEU A 438 HIS A 422 LEU A 272	None	1.28A	5toaB-3v4cA: undetectable	5toaB-3v4cA: 19.32
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.	5UTU_F_ADNF503_1 (ADENOSYLHOMOCYSTEINA SE)	3v4c	ALDEHYDE DEHYDROGENASE (NADP+) (Sinorhizobium meliloti)	5 / 12	LEU A 446 THR A 452 GLY A 463 HIS A 462 MET A 460	None	1.36A	5utuF-3v4cA: undetectable	5utuF-3v4cA: 20.68
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.	5VOP_A_C2FA3001_0 (5-METHYLTETRAHYDROFO LATE HOMOCYSTEINE S-METHYLTRANSFERASE)	3v4c	ALDEHYDE DEHYDROGENASE (NADP+) (Sinorhizobium meliloti)	5 / 12	GLY A 453 VAL A 328 LEU A 325 GLY A 297 ASN A 302	None	1.07A	5vopA-3v4cA: undetectable	5vopA-3v4cA: 22.47
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.	5X66_A_MTXA402_1 (THYMIDYLATE SYNTHASE)	3v4c	ALDEHYDE DEHYDROGENASE (NADP+) (Sinorhizobium meliloti)	5 / 12	ARG A 254 GLY A 262 PHE A 261 ASN A 471 ALA A 155	None	1.11A	5x66A-3v4cA: undetectable 5x66B-3v4cA: undetectable	5x66A-3v4cA: 21.34 5x66B-3v4cA: 21.34
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.	5X66_D_MTXD402_1 (THYMIDYLATE SYNTHASE)	3v4c	ALDEHYDE DEHYDROGENASE (NADP+) (Sinorhizobium meliloti)	5 / 10	ARG A 254 GLY A 262 PHE A 261 ASN A 471 ALA A 155	None	1.10A	5x66D-3v4cA: undetectable	5x66D-3v4cA: 21.34
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.	6AG0_A_ACRA606_0 (ALPHA-AMYLASE)	3v4c	ALDEHYDE DEHYDROGENASE (NADP+) (Sinorhizobium meliloti)	5 / 7	GLY A 20 GLY A 18 GLY A 37 GLY A 218 GLY A 217	None	0.84A	6ag0A-3v4cA: undetectable	6ag0A-3v4cA: 10.32
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.	6AG0_C_ACRC607_0 (ALPHA-AMYLASE)	3v4c	ALDEHYDE DEHYDROGENASE (NADP+) (Sinorhizobium meliloti)	4 / 6	GLY A 20 ASP A 33 GLY A 37 GLY A 217	None	0.74A	6ag0C-3v4cA: undetectable	6ag0C-3v4cA: 10.32

[["DrReposER ID","Desc.","Hit PDB","Hit molecule","Hit organism","Res. no.","Interface","HETATM","RMSD","Z-score","Seq ID"],["1C9S_J_TRPJ81_0","TRP RNA-BINDING ATTENUATION PROTEIN","3v4c","ALDEHYDE DEHYDROGENASE (NADP+)","Sinorhizobium meliloti",4,"SER A 163;GLY A  86;THR A 190;ILE A  82","None","0.76A","1c9sI-3v4cA:undetectable;1c9sJ-3v4cA:undetectable","1c9sI-3v4cA:10.56;1c9sJ-3v4cA:10.56"],["1C9S_U_TRPU81_0","TRP RNA-BINDING ATTENUATION PROTEIN","3v4c","ALDEHYDE DEHYDROGENASE (NADP+)","Sinorhizobium meliloti",4,"GLY A  86;THR A 190;ILE A  82;SER A 163","None","0.80A","1c9sU-3v4cA:undetectable;1c9sV-3v4cA:undetectable","1c9sU-3v4cA:10.56;1c9sV-3v4cA:10.56"],["1D4F_B_ADNB602_2","S-ADENOSYLHOMOCYSTEINE HYDROLASE","3v4c","ALDEHYDE DEHYDROGENASE (NADP+)","Sinorhizobium meliloti",4,"THR A 164;GLU A  89;THR A  90;HIS A 184","None","1.42A","1d4fB-3v4cA:4.5","1d4fB-3v4cA:20.22"],["1GTN_A_TRPA81_0","TRP RNA-BINDING ATTENUATION PROTEIN","3v4c","ALDEHYDE DEHYDROGENASE (NADP+)","Sinorhizobium meliloti",4,"GLY A  86;THR A 190;ILE A  82;SER A 163","None","0.71A","1gtnA-3v4cA:undetectable;1gtnK-3v4cA:undetectable","1gtnA-3v4cA:10.56;1gtnK-3v4cA:10.56"],["1GTN_E_TRPE81_0","TRP RNA-BINDING ATTENUATION PROTEIN","3v4c","ALDEHYDE DEHYDROGENASE (NADP+)","Sinorhizobium meliloti",4,"SER A 163;GLY A  86;THR A 190;ILE A  82","None","0.73A","1gtnD-3v4cA:undetectable;1gtnE-3v4cA:undetectable","1gtnD-3v4cA:10.56;1gtnE-3v4cA:10.56"],["1GTN_F_TRPF81_0","TRP RNA-BINDING ATTENUATION PROTEIN","3v4c","ALDEHYDE DEHYDROGENASE (NADP+)","Sinorhizobium meliloti",4,"SER A 163;GLY A  86;THR A 190;ILE A  82","None","0.76A","1gtnE-3v4cA:undetectable;1gtnF-3v4cA:undetectable","1gtnE-3v4cA:10.56;1gtnF-3v4cA:10.56"],["1GTN_G_TRPG81_0","TRP RNA-BINDING ATTENUATION PROTEIN","3v4c","ALDEHYDE DEHYDROGENASE (NADP+)","Sinorhizobium meliloti",4,"SER A 163;GLY A  86;THR A 190;ILE A  82","None","0.77A","1gtnF-3v4cA:undetectable;1gtnG-3v4cA:undetectable","1gtnF-3v4cA:10.56;1gtnG-3v4cA:10.56"],["1GTN_J_TRPJ81_0","TRP RNA-BINDING ATTENUATION PROTEIN","3v4c","ALDEHYDE DEHYDROGENASE (NADP+)","Sinorhizobium meliloti",4,"SER A 163;GLY A  86;THR A 190;ILE A  82","None","0.72A","1gtnI-3v4cA:undetectable;1gtnJ-3v4cA:undetectable","1gtnI-3v4cA:10.56;1gtnJ-3v4cA:10.56"],["1GTN_K_TRPK81_0","TRP RNA-BINDING ATTENUATION PROTEIN","3v4c","ALDEHYDE DEHYDROGENASE (NADP+)","Sinorhizobium meliloti",4,"SER A 163;GLY A  86;THR A 190;ILE A  82","None","0.74A","1gtnJ-3v4cA:undetectable;1gtnK-3v4cA:undetectable","1gtnJ-3v4cA:10.56;1gtnK-3v4cA:10.56"],["1UTD_I_TRPI81_0","TRANSCRIPTION ATTENUATION PROTEIN MTRB","3v4c","ALDEHYDE DEHYDROGENASE (NADP+)","Sinorhizobium meliloti",4,"GLY A  86;THR A 190;ILE A  82;SER A 163","None","0.78A","1utdI-3v4cA:undetectable;1utdJ-3v4cA:undetectable","1utdI-3v4cA:10.56;1utdJ-3v4cA:10.56"],["1V8B_A_ADNA502_1","ADENOSYLHOMOCYSTEINASE","3v4c","ALDEHYDE DEHYDROGENASE (NADP+)","Sinorhizobium meliloti",5,"LEU A 446;THR A 452;GLY A 463;HIS A 462;MET A 460","None","1.33A","1v8bA-3v4cA:undetectable","1v8bA-3v4cA:19.32"],["1V8B_B_ADNB1502_1","ADENOSYLHOMOCYSTEINASE","3v4c","ALDEHYDE DEHYDROGENASE (NADP+)","Sinorhizobium meliloti",5,"LEU A 446;THR A 452;GLY A 463;HIS A 462;MET A 460","None","1.30A","1v8bB-3v4cA:undetectable","1v8bB-3v4cA:19.32"],["1V8B_D_ADND3502_1","ADENOSYLHOMOCYSTEINASE","3v4c","ALDEHYDE DEHYDROGENASE (NADP+)","Sinorhizobium meliloti",5,"LEU A 446;THR A 452;GLY A 463;HIS A 462;MET A 460","None","1.30A","1v8bD-3v4cA:2.5","1v8bD-3v4cA:19.32"],["2BXG_A_IBPA2001_1","SERUM ALBUMIN","3v4c","ALDEHYDE DEHYDROGENASE (NADP+)","Sinorhizobium meliloti",5,"VAL A 147;GLY A 148;ALA A 234;ARG A 484;SER A 481","None","1.19A","2bxgA-3v4cA:3.6","2bxgA-3v4cA:22.22"],["2BXM_A_IMNA2002_1","SERUM ALBUMIN","3v4c","ALDEHYDE DEHYDROGENASE (NADP+)","Sinorhizobium meliloti",5,"ARG A  96;LEU A 160;ILE A  75;ARG A 103;GLY A 106","None;None;None;PE4 A 506 (-4.5A);PE4 A 506 ( 4.1A)","1.21A","2bxmA-3v4cA:4.7","2bxmA-3v4cA:22.22"],["2HJH_B_NCAB901_0","NAD-DEPENDENT HISTONE DEACETYLASE SIR2","3v4c","ALDEHYDE DEHYDROGENASE (NADP+)","Sinorhizobium meliloti",4,"ILE A 232;PRO A 149;PHE A 485;VAL A 179","None","1.24A","2hjhB-3v4cA:5.1","2hjhB-3v4cA:17.76"],["2Q64_B_1UNB1001_2","PROTEASE RETROPEPSIN;PROTEASE RETROPEPSIN","3v4c","ALDEHYDE DEHYDROGENASE (NADP+)","Sinorhizobium meliloti",3,"ARG A 103;THR A 475;VAL A 477","PE4 A 506 (-4.5A);None;None","0.96A","2q64A-3v4cA:undetectable","2q64A-3v4cA:11.41"],["2V0M_B_KLNB1498_1","CYTOCHROME P450 3A4","3v4c","ALDEHYDE DEHYDROGENASE (NADP+)","Sinorhizobium meliloti",5,"PHE A 349;ARG A 399;ALA A 320;GLY A 395;LEU A 372","None","0.97A","2v0mB-3v4cA:undetectable","2v0mB-3v4cA:22.14"],["2VDY_A_HCYA1384_1","CORTICOSTEROID-BINDING GLOBULIN","3v4c","ALDEHYDE DEHYDROGENASE (NADP+)","Sinorhizobium meliloti",5,"PHE A 237;ARG A 220;SER A 240;PHE A 153;HIS A 184","None","1.46A","2vdyA-3v4cA:undetectable","2vdyA-3v4cA:22.51"],["2VL2_A_BEZA1162_0","PEROXIREDOXIN-5","3v4c","ALDEHYDE DEHYDROGENASE (NADP+)","Sinorhizobium meliloti",5,"THR A 169;GLY A 166;LEU A 214;PHE A 212;GLY A 191","None","1.49A","2vl2A-3v4cA:undetectable;2vl2C-3v4cA:3.1","2vl2A-3v4cA:18.04;2vl2C-3v4cA:18.04"],["2XCT_G_CPFG1020_1","DNA GYRASE SUBUNIT B, DNA GYRASE SUBUNIT A","3v4c","ALDEHYDE DEHYDROGENASE (NADP+)","Sinorhizobium meliloti",3,"ARG A 245;GLY A 244;SER A 476","None","0.57A","2xctB-3v4cA:2.7","2xctB-3v4cA:22.54"],["3BOG_C_DHIC8_0","6.5 KDA GLYCINE-RICH ANTIFREEZE PROTEIN","3v4c","ALDEHYDE DEHYDROGENASE (NADP+)","Sinorhizobium meliloti",3,"SER A 266;GLY A 415;GLY A 464","None","0.51A","3bogA-3v4cA:undetectable;3bogC-3v4cA:undetectable","3bogA-3v4cA:undetectable;3bogC-3v4cA:undetectable"],["3F8F_A_DM1A127_1","TRANSCRIPTIONAL REGULATOR, PADR-LIKE FAMILY;TRANSCRIPTIONAL REGULATOR, PADR-LIKE FAMILY","3v4c","ALDEHYDE DEHYDROGENASE (NADP+)","Sinorhizobium meliloti",5,"MET A 270;ALA A 306;VAL A 397;ALA A 314;TRP A 288","None","1.50A","3f8fA-3v4cA:undetectable;3f8fB-3v4cA:undetectable","3f8fA-3v4cA:12.12;3f8fB-3v4cA:12.12"],["3G1U_D_ADND438_1","ADENOSYLHOMOCYSTEINASE","3v4c","ALDEHYDE DEHYDROGENASE (NADP+)","Sinorhizobium meliloti",5,"LEU A 446;THR A 452;GLY A 463;HIS A 462;MET A 460","None","1.29A","3g1uD-3v4cA:2.1","3g1uD-3v4cA:21.38"],["3P5N_A_RBFA190_1","RIBOFLAVIN UPTAKE PROTEIN","3v4c","ALDEHYDE DEHYDROGENASE (NADP+)","Sinorhizobium meliloti",5,"LEU A 110;GLY A 167;ALA A 170;ALA A 174;LEU A  68","None","1.14A","3p5nA-3v4cA:undetectable","3p5nA-3v4cA:16.37"],["3P5N_B_RBFB190_1","RIBOFLAVIN UPTAKE PROTEIN","3v4c","ALDEHYDE DEHYDROGENASE (NADP+)","Sinorhizobium meliloti",5,"LEU A 110;GLY A 167;ALA A 170;ALA A 174;LEU A  68","None","1.13A","3p5nB-3v4cA:undetectable","3p5nB-3v4cA:16.37"],["3TEG_A_DAHA416_1","PHENYLALANYL-TRNA SYNTHETASE, MITOCHONDRIAL","3v4c","ALDEHYDE DEHYDROGENASE (NADP+)","Sinorhizobium meliloti",5,"SER A 163;THR A  90;GLY A 189;GLY A  86;GLY A 191","None","1.16A","3tegA-3v4cA:undetectable","3tegA-3v4cA:22.20"],["4DUB_B_LDPB501_1","CYTOCHROME P450 BM3 VARIANT 9D7","3v4c","ALDEHYDE DEHYDROGENASE (NADP+)","Sinorhizobium meliloti",4,"ALA A 246;GLY A 223;LEU A 250;VAL A 227","None","0.88A","4dubB-3v4cA:undetectable","4dubB-3v4cA:21.97"],["4J7X_A_SASA806_1","SEPIAPTERIN REDUCTASE","3v4c","ALDEHYDE DEHYDROGENASE (NADP+)","Sinorhizobium meliloti",5,"SER A 363;TYR A 342;GLN A 331;ALA A 296;GLY A  91","None","1.48A","4j7xA-3v4cA:undetectable","4j7xA-3v4cA:20.45"],["4XE3_B_CL6B502_1","CYTOCHROME P-450","3v4c","ALDEHYDE DEHYDROGENASE (NADP+)","Sinorhizobium meliloti",4,"LEU A 108;ALA A 197;VAL A 211;ILE A 202","None","0.97A","4xe3B-3v4cA:undetectable","4xe3B-3v4cA:22.90"],["5BPH_A_ACTA403_0","D-ALANINE--D-ALANINE LIGASE","3v4c","ALDEHYDE DEHYDROGENASE (NADP+)","Sinorhizobium meliloti",4,"TYR A 466;GLY A 243;SER A 240;LEU A 264","None","1.27A","5bphA-3v4cA:3.6","5bphA-3v4cA:20.57"],["5BPH_C_ACTC403_0","D-ALANINE--D-ALANINE LIGASE","3v4c","ALDEHYDE DEHYDROGENASE (NADP+)","Sinorhizobium meliloti",4,"TYR A 466;GLY A 243;SER A 240;LEU A 264","None","1.27A","5bphC-3v4cA:3.6","5bphC-3v4cA:20.57"],["5DZK_R_BEZR801_1","ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 2;BEZ-LEU-LEU","3v4c","ALDEHYDE DEHYDROGENASE (NADP+)","Sinorhizobium meliloti",4,"ALA A 289;PRO A 370;LEU A 372;LEU A 359","None","1.11A","5dzkd-3v4cA:3.1;5dzkr-3v4cA:undetectable","5dzkd-3v4cA:19.92;5dzkr-3v4cA:0.68"],["5DZK_T_BEZT801_1","ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 2;BEZ-LEU-LEU","3v4c","ALDEHYDE DEHYDROGENASE (NADP+)","Sinorhizobium meliloti",4,"ALA A 289;PRO A 370;LEU A 372;LEU A 359","None","0.86A","5dzkF-3v4cA:3.0;5dzkT-3v4cA:undetectable","5dzkF-3v4cA:19.92;5dzkT-3v4cA:0.68"],["5M5K_B_ADNB502_1","ADENOSYLHOMOCYSTEINASE","3v4c","ALDEHYDE DEHYDROGENASE (NADP+)","Sinorhizobium meliloti",5,"LEU A 446;THR A 452;GLY A 463;HIS A 462;MET A 460","None","1.30A","5m5kB-3v4cA:undetectable","5m5kB-3v4cA:23.53"],["5M66_A_ADNA502_1","ADENOSYLHOMOCYSTEINASE","3v4c","ALDEHYDE DEHYDROGENASE (NADP+)","Sinorhizobium meliloti",5,"LEU A 446;THR A 452;GLY A 463;HIS A 462;MET A 460","None","1.30A","5m66A-3v4cA:2.2","5m66A-3v4cA:23.53"],["5PBE_A_TYLA2001_1","BROMODOMAIN ADJACENT TO ZINC FINGER DOMAIN PROTEIN 2B","3v4c","ALDEHYDE DEHYDROGENASE (NADP+)","Sinorhizobium meliloti",4,"VAL A 211;VAL A 207;TYR A  56;ILE A  71","None","0.88A","5pbeA-3v4cA:2.5","5pbeA-3v4cA:15.73"],["5TOA_B_ESTB601_1","ESTROGEN RECEPTOR BETA","3v4c","ALDEHYDE DEHYDROGENASE (NADP+)","Sinorhizobium meliloti",5,"MET A 406;ILE A 421;LEU A 438;HIS A 422;LEU A 272","None","1.28A","5toaB-3v4cA:undetectable","5toaB-3v4cA:19.32"],["5UTU_F_ADNF503_1","ADENOSYLHOMOCYSTEINASE","3v4c","ALDEHYDE DEHYDROGENASE (NADP+)","Sinorhizobium meliloti",5,"LEU A 446;THR A 452;GLY A 463;HIS A 462;MET A 460","None","1.36A","5utuF-3v4cA:undetectable","5utuF-3v4cA:20.68"],["5VOP_A_C2FA3001_0","5-METHYLTETRAHYDROFOLATE HOMOCYSTEINE S-METHYLTRANSFERASE","3v4c","ALDEHYDE DEHYDROGENASE (NADP+)","Sinorhizobium meliloti",5,"GLY A 453;VAL A 328;LEU A 325;GLY A 297;ASN A 302","None","1.07A","5vopA-3v4cA:undetectable","5vopA-3v4cA:22.47"],["5X66_A_MTXA402_1","THYMIDYLATE SYNTHASE;THYMIDYLATE SYNTHASE","3v4c","ALDEHYDE DEHYDROGENASE (NADP+)","Sinorhizobium meliloti",5,"ARG A 254;GLY A 262;PHE A 261;ASN A 471;ALA A 155","None","1.11A","5x66A-3v4cA:undetectable;5x66B-3v4cA:undetectable","5x66A-3v4cA:21.34;5x66B-3v4cA:21.34"],["5X66_D_MTXD402_1","THYMIDYLATE SYNTHASE","3v4c","ALDEHYDE DEHYDROGENASE (NADP+)","Sinorhizobium meliloti",5,"ARG A 254;GLY A 262;PHE A 261;ASN A 471;ALA A 155","None","1.10A","5x66D-3v4cA:undetectable","5x66D-3v4cA:21.34"],["6AG0_A_ACRA606_0","ALPHA-AMYLASE","3v4c","ALDEHYDE DEHYDROGENASE (NADP+)","Sinorhizobium meliloti",5,"GLY A  20;GLY A  18;GLY A  37;GLY A 218;GLY A 217","None","0.84A","6ag0A-3v4cA:undetectable","6ag0A-3v4cA:10.32"],["6AG0_C_ACRC607_0","ALPHA-AMYLASE","3v4c","ALDEHYDE DEHYDROGENASE (NADP+)","Sinorhizobium meliloti",4,"GLY A  20;ASP A  33;GLY A  37;GLY A 217","None","0.74A","6ag0C-3v4cA:undetectable","6ag0C-3v4cA:10.32"]]