SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3ian'

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.	1AV2_A_DVAA6_0 (GRAMICIDIN A)	3ian	CHITINASE (Lactococcus lactis)	3 / 3	ALA A 327 VAL A 323 TRP A 49	EDO A 364 ( 4.2A) None None	0.95A	1av2A-3ianA: undetectable 1av2B-3ianA: undetectable	1av2A-3ianA: 3.25 1av2B-3ianA: 3.25
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.	1D4Y_A_TPVA501_2 (PROTEIN (HIV-1 PROTEASE))	3ian	CHITINASE (Lactococcus lactis)	4 / 8	LEU A 121 ASP A 158 GLY A 282 VAL A 79	None	0.71A	1d4yB-3ianA: undetectable	1d4yB-3ianA: 13.93
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.	1IKV_A_EFZA2000_1 (POL POLYPROTEIN)	3ian	CHITINASE (Lactococcus lactis)	5 / 9	LEU A 283 TYR A 344 GLY A 317 LEU A 257 TYR A 228	None EDO A 362 (-4.7A) None None None	1.39A	1ikvA-3ianA: undetectable	1ikvA-3ianA: 20.69
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.	1IKW_A_EFZA2000_1 (POL POLYPROTEIN)	3ian	CHITINASE (Lactococcus lactis)	5 / 10	LEU A 283 TYR A 344 GLY A 317 LEU A 257 TYR A 228	None EDO A 362 (-4.7A) None None None	1.43A	1ikwA-3ianA: undetectable	1ikwA-3ianA: 20.87
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.	1OIP_A_VIVA1278_1 (ALPHA-TOCOPHEROL TRANSFER PROTEIN)	3ian	CHITINASE (Lactococcus lactis)	4 / 5	SER A 285 PHE A 68 VAL A 341 PHE A 340	None EDO A 364 ( 3.5A) None None	1.47A	1oipA-3ianA: 2.6	1oipA-3ianA: 17.21
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.	1TDR_B_MTXB170_1 (TELLUROMETHIONYL DIHYDROFOLATE REDUCTASE)	3ian	CHITINASE (Lactococcus lactis)	5 / 10	ALA A 198 ASP A 158 LEU A 157 ILE A 131 TYR A 203	EDO A 361 ( 4.7A) None None None None	1.50A	1tdrB-3ianA: undetectable	1tdrB-3ianA: 16.26
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.	1W5U_A_DVAA6_0 (GRAMICIDIN D)	3ian	CHITINASE (Lactococcus lactis)	3 / 3	ALA A 327 VAL A 323 TRP A 49	EDO A 364 ( 4.2A) None None	0.93A	1w5uA-3ianA: undetectable 1w5uB-3ianA: undetectable	1w5uA-3ianA: 3.25 1w5uB-3ianA: 3.25
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.	1WG8_A_SAMA3142_1 (PREDICTED S-ADENOSYLMETHIONINE -DEPENDENT METHYLTRANSFERASE)	3ian	CHITINASE (Lactococcus lactis)	4 / 4	HIS A 358 ASP A 222 ASN A 225 ASP A 155	NA A 1 ( 4.8A) EDO A 366 (-3.1A) None NA A 1 ( 2.9A)	1.36A	1wg8A-3ianA: 0.7	1wg8A-3ianA: 23.12
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.	1XOQ_A_ROFA502_1 (CAMP-SPECIFIC 3',5'-CYCLIC PHOSPHODIESTERASE 4D)	3ian	CHITINASE (Lactococcus lactis)	3 / 3	ASN A 324 TRP A 49 GLN A 74	None None EDO A 364 (-4.0A)	1.37A	1xoqA-3ianA: undetectable	1xoqA-3ianA: 22.88
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.	2A3B_B_CFFB2435_1 (CHITINASE)	3ian	CHITINASE (Lactococcus lactis)	5 / 10	PHE A 84 GLY A 126 ASP A 160 TYR A 229 TRP A 321	None EDO A 369 ( 3.7A) EDO A 361 ( 2.7A) EDO A 361 (-4.5A) EDO A 361 (-4.5A)	0.92A	2a3bB-3ianA: 21.7	2a3bB-3ianA: 24.28
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.	2A3C_A_PNXA1434_1 (CHITINASE)	3ian	CHITINASE (Lactococcus lactis)	7 / 12	TYR A 48 TRP A 52 PHE A 84 GLY A 126 ASP A 160 TYR A 229 TRP A 321	EDO A 361 ( 4.2A) None None EDO A 369 ( 3.7A) EDO A 361 ( 2.7A) EDO A 361 (-4.5A) EDO A 361 (-4.5A)	1.03A	2a3cA-3ianA: 21.7	2a3cA-3ianA: 24.28
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.	2A3C_B_PNXB2433_1 (CHITINASE)	3ian	CHITINASE (Lactococcus lactis)	6 / 12	TRP A 52 PHE A 84 GLY A 126 ASP A 160 TYR A 229 TRP A 321	None None EDO A 369 ( 3.7A) EDO A 361 ( 2.7A) EDO A 361 (-4.5A) EDO A 361 (-4.5A)	0.99A	2a3cB-3ianA: 21.8	2a3cB-3ianA: 24.28
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.	2AOJ_C_FRDC305_1 (POL POLYPROTEIN PEPTIDE INHIBITOR)	3ian	CHITINASE (Lactococcus lactis)	4 / 5	LEU A 121 ASP A 158 GLY A 282 VAL A 79	None	0.84A	2aojA-3ianA: undetectable	2aojA-3ianA: 13.93
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.	2AVV_A_MK1A901_2 (POL POLYPROTEIN)	3ian	CHITINASE (Lactococcus lactis)	3 / 3	ASP A 155 VAL A 82 PRO A 98	NA A 1 ( 2.9A) None None	0.71A	2avvA-3ianA: undetectable	2avvA-3ianA: 13.93
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.	2FK8_A_SAMA302_1 (METHOXY MYCOLIC ACID SYNTHASE 4)	3ian	CHITINASE (Lactococcus lactis)	3 / 3	SER A 239 THR A 266 GLN A 262	None	0.76A	2fk8A-3ianA: undetectable	2fk8A-3ianA: 21.64
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.	2IZQ_D_DVAD6_0 (GRAMICIDIN D)	3ian	CHITINASE (Lactococcus lactis)	3 / 3	TRP A 49 ALA A 327 VAL A 323	None EDO A 364 ( 4.2A) None	0.95A	2izqC-3ianA: undetectable 2izqD-3ianA: undetectable	2izqC-3ianA: 3.25 2izqD-3ianA: 3.25
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.	2PKM_A_ADNA501_1 (ADENOSINE KINASE)	3ian	CHITINASE (Lactococcus lactis)	5 / 12	ALA A 327 GLY A 328 PHE A 68 GLY A 56 ASP A 58	EDO A 364 ( 4.2A) None EDO A 364 ( 3.5A) None None	0.93A	2pkmA-3ianA: undetectable	2pkmA-3ianA: 21.45
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.	2PO5_B_CHDB501_0 (FERROCHELATASE, MITOCHONDRIAL)	3ian	CHITINASE (Lactococcus lactis)	5 / 11	LEU A 305 LEU A 348 MET A 347 VAL A 341 VAL A 295	None	1.34A	2po5B-3ianA: undetectable	2po5B-3ianA: 19.68
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.	2QX4_B_ML1B233_1 (RIBOSYLDIHYDRONICOTI NAMIDE DEHYDROGENASE [QUINONE])	3ian	CHITINASE (Lactococcus lactis)	4 / 7	GLY A 232 THR A 292 GLN A 231 PHE A 201	None	1.03A	2qx4A-3ianA: undetectable 2qx4B-3ianA: undetectable	2qx4A-3ianA: 23.31 2qx4B-3ianA: 23.31
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.	2UY4_A_AZMA1311_1 (ENDOCHITINASE)	3ian	CHITINASE (Lactococcus lactis)	5 / 9	TYR A 48 PHE A 84 GLY A 125 ASP A 160 GLN A 227	EDO A 361 ( 4.2A) None None EDO A 361 ( 2.7A) EDO A 369 ( 3.3A)	1.11A	2uy4A-3ianA: 23.8	2uy4A-3ianA: 24.71
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.	2UY4_A_AZMA1311_1 (ENDOCHITINASE)	3ian	CHITINASE (Lactococcus lactis)	5 / 9	TYR A 48 PHE A 84 GLY A 126 ALA A 127 TRP A 321	EDO A 361 ( 4.2A) None EDO A 369 ( 3.7A) EDO A 369 (-4.5A) EDO A 361 (-4.5A)	0.71A	2uy4A-3ianA: 23.8	2uy4A-3ianA: 24.71
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.	2UY4_A_AZMA1311_1 (ENDOCHITINASE)	3ian	CHITINASE (Lactococcus lactis)	7 / 9	TYR A 48 PHE A 84 GLY A 126 ASP A 160 GLN A 227 TYR A 229 TRP A 321	EDO A 361 ( 4.2A) None EDO A 369 ( 3.7A) EDO A 361 ( 2.7A) EDO A 369 ( 3.3A) EDO A 361 (-4.5A) EDO A 361 (-4.5A)	0.35A	2uy4A-3ianA: 23.8	2uy4A-3ianA: 24.71
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.	2VQ5_B_LDPB1197_1 (S-NORCOCLAURINE SYNTHASE)	3ian	CHITINASE (Lactococcus lactis)	4 / 7	LEU A 318 LEU A 283 LEU A 348 PRO A 298	None None None EDO A 362 (-4.1A)	0.89A	2vq5B-3ianA: undetectable	2vq5B-3ianA: 18.84
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.	2X45_B_HSMB1162_1 (ALLERGEN ARG R 1)	3ian	CHITINASE (Lactococcus lactis)	3 / 3	GLU A 314 HIS A 354 GLU A 352	None	0.82A	2x45B-3ianA: undetectable	2x45B-3ianA: 19.81
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.	2X45_C_HSMC1162_1 (ALLERGEN ARG R 1)	3ian	CHITINASE (Lactococcus lactis)	3 / 3	GLU A 314 HIS A 354 GLU A 352	None	0.82A	2x45C-3ianA: undetectable	2x45C-3ianA: 19.81
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.	2XTK_A_AZMA1339_1 (CLASS III CHITINASE CHIA1)	3ian	CHITINASE (Lactococcus lactis)	10 / 11	TYR A 48 PHE A 84 GLY A 126 ALA A 127 ASP A 160 GLN A 227 TYR A 229 ASN A 230 ALA A 290 TRP A 321	EDO A 361 ( 4.2A) None EDO A 369 ( 3.7A) EDO A 369 (-4.5A) EDO A 361 ( 2.7A) EDO A 369 ( 3.3A) EDO A 361 (-4.5A) None None EDO A 361 (-4.5A)	0.67A	2xtkA-3ianA: 23.6	2xtkA-3ianA: 23.93
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.	2XTK_A_AZMA1339_1 (CLASS III CHITINASE CHIA1)	3ian	CHITINASE (Lactococcus lactis)	6 / 11	TYR A 48 PHE A 84 GLY A 126 ASP A 160 ALA A 289 TRP A 321	EDO A 361 ( 4.2A) None EDO A 369 ( 3.7A) EDO A 361 ( 2.7A) None EDO A 361 (-4.5A)	1.09A	2xtkA-3ianA: 23.6	2xtkA-3ianA: 23.93
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.	2XTK_B_AZMB1339_1 (CLASS III CHITINASE CHIA1)	3ian	CHITINASE (Lactococcus lactis)	7 / 10	TYR A 48 PHE A 84 GLY A 126 ALA A 127 ASP A 160 GLN A 227 TRP A 321	EDO A 361 ( 4.2A) None EDO A 369 ( 3.7A) EDO A 369 (-4.5A) EDO A 361 ( 2.7A) EDO A 369 ( 3.3A) EDO A 361 (-4.5A)	0.75A	2xtkB-3ianA: 23.7	2xtkB-3ianA: 23.93
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.	2XTK_B_AZMB1339_1 (CLASS III CHITINASE CHIA1)	3ian	CHITINASE (Lactococcus lactis)	7 / 10	TYR A 48 PHE A 84 GLY A 126 ASP A 160 GLN A 227 TYR A 229 TRP A 321	EDO A 361 ( 4.2A) None EDO A 369 ( 3.7A) EDO A 361 ( 2.7A) EDO A 369 ( 3.3A) EDO A 361 (-4.5A) EDO A 361 (-4.5A)	0.48A	2xtkB-3ianA: 23.7	2xtkB-3ianA: 23.93
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.	3ADS_A_IMNA2_2 (PEROXISOME PROLIFERATOR-ACTIVAT ED RECEPTOR GAMMA)	3ian	CHITINASE (Lactococcus lactis)	4 / 6	ILE A 281 ILE A 214 TYR A 210 LEU A 283	None	0.72A	3adsA-3ianA: undetectable	3adsA-3ianA: 19.48
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.	3G6M_A_CFFA1_1 (CHITINASE)	3ian	CHITINASE (Lactococcus lactis)	6 / 11	TYR A 48 PHE A 84 GLY A 126 ASP A 160 TYR A 229 TRP A 321	EDO A 361 ( 4.2A) None EDO A 369 ( 3.7A) EDO A 361 ( 2.7A) EDO A 361 (-4.5A) EDO A 361 (-4.5A)	1.00A	3g6mA-3ianA: 21.2	3g6mA-3ianA: 24.70
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.	3HVT_A_NVPA557_1 (HIV-1 REVERSE TRANSCRIPTASE (SUBUNIT P66))	3ian	CHITINASE (Lactococcus lactis)	5 / 9	LEU A 283 TYR A 344 GLY A 317 LEU A 257 TYR A 228	None EDO A 362 (-4.7A) None None None	1.30A	3hvtA-3ianA: undetectable	3hvtA-3ianA: 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.	3VKX_A_T3A301_1 (PROLIFERATING CELL NUCLEAR ANTIGEN)	3ian	CHITINASE (Lactococcus lactis)	4 / 6	LEU A 260 PRO A 202 GLN A 231 TYR A 228	None	1.48A	3vkxA-3ianA: undetectable	3vkxA-3ianA: 23.60
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.	3W1W_A_CHDA1502_0 (FERROCHELATASE, MITOCHONDRIAL)	3ian	CHITINASE (Lactococcus lactis)	5 / 12	LEU A 305 LEU A 348 MET A 347 VAL A 341 VAL A 295	None	1.28A	3w1wA-3ianA: undetectable	3w1wA-3ianA: 19.22
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.	3WQV_A_GCSA501_1 (CHITINASE)	3ian	CHITINASE (Lactococcus lactis)	5 / 11	PHE A 84 GLY A 126 ASP A 160 TYR A 229 TRP A 321	None EDO A 369 ( 3.7A) EDO A 361 ( 2.7A) EDO A 361 (-4.5A) EDO A 361 (-4.5A)	0.55A	3wqvA-3ianA: 21.3	3wqvA-3ianA: 25.84
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.	3WQW_A_GCSA501_1 (CHITINASE)	3ian	CHITINASE (Lactococcus lactis)	5 / 11	PHE A 84 GLY A 126 ASP A 160 TYR A 229 TRP A 321	None EDO A 369 ( 3.7A) EDO A 361 ( 2.7A) EDO A 361 (-4.5A) EDO A 361 (-4.5A)	0.56A	3wqwA-3ianA: 21.2	3wqwA-3ianA: 25.84
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.	4KN2_C_LYAC304_2 (FOLATE RECEPTOR BETA)	3ian	CHITINASE (Lactococcus lactis)	3 / 3	TYR A 60 GLN A 247 TRP A 321	None None EDO A 361 (-4.5A)	0.85A	4kn2C-3ianA: undetectable	4kn2C-3ianA: 22.40
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.	4Z4H_A_IPHA904_0 (PROTEIN ARGONAUTE-2)	3ian	CHITINASE (Lactococcus lactis)	4 / 5	GLN A 227 PRO A 199 ILE A 159 ASP A 158	EDO A 369 ( 3.3A) None None None	1.40A	4z4hA-3ianA: undetectable	4z4hA-3ianA: 16.84
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.	5GQB_A_GCSA603_1 (CHITINASE)	3ian	CHITINASE (Lactococcus lactis)	4 / 8	PHE A 84 GLY A 126 TYR A 229 TRP A 321	None EDO A 369 ( 3.7A) EDO A 361 (-4.5A) EDO A 361 (-4.5A)	0.46A	5gqbA-3ianA: 10.2	5gqbA-3ianA: 19.46
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.	5IEN_B_VDYB201_1 (CDL2.2)	3ian	CHITINASE (Lactococcus lactis)	5 / 10	ILE A 145 LEU A 179 ILE A 131 LEU A 161 PRO A 199	None	1.12A	5ienB-3ianA: undetectable	5ienB-3ianA: 21.81
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.	5UIH_A_8CVA201_1 (DIHYDROFOLATE REDUCTASE)	3ian	CHITINASE (Lactococcus lactis)	4 / 8	ALA A 198 ASP A 158 LEU A 121 TYR A 229	EDO A 361 ( 4.7A) None None EDO A 361 (-4.5A)	0.87A	5uihA-3ianA: undetectable	5uihA-3ianA: 13.80
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.	5X7P_A_ACRA1431_1 (GLYCOSIDE HYDROLASE FAMILY 31 ALPHA-GLUCOSIDASE)	3ian	CHITINASE (Lactococcus lactis)	4 / 7	ASN A 225 ASP A 158 GLY A 156 ASN A 81	None	1.12A	5x7pA-3ianA: undetectable	5x7pA-3ianA: 13.05
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.	6BSJ_A_EFZA601_1 (REVERSE TRANSCRIPTASE P66 SUBUNIT)	3ian	CHITINASE (Lactococcus lactis)	5 / 10	LEU A 283 TYR A 344 GLY A 317 LEU A 257 TYR A 228	None EDO A 362 (-4.7A) None None None	1.35A	6bsjA-3ianA: undetectable	6bsjA-3ianA: 14.93
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.	6GQI_A_ACTA604_0 (CYCLOHEXANONE MONOOXYGENASE FROM THERMOCRISPUM MUNICIPALE)	3ian	CHITINASE (Lactococcus lactis)	4 / 6	PRO A 212 ILE A 166 GLY A 208 TYR A 210	None	1.05A	6gqiA-3ianA: undetectable	6gqiA-3ianA: 19.96

[["DrReposER ID","Desc.","Hit PDB","Hit molecule","Hit organism","Res. no.","Interface","HETATM","RMSD","Z-score","Seq ID"],["1AV2_A_DVAA6_0","GRAMICIDIN A","3ian","CHITINASE","Lactococcus lactis",3,"ALA A 327;VAL A 323;TRP A  49","EDO A 364 ( 4.2A);None;None","0.95A","1av2A-3ianA:undetectable;1av2B-3ianA:undetectable","1av2A-3ianA:3.25;1av2B-3ianA:3.25"],["1D4Y_A_TPVA501_2","PROTEIN (HIV-1 PROTEASE);PROTEIN (HIV-1 PROTEASE)","3ian","CHITINASE","Lactococcus lactis",4,"LEU A 121;ASP A 158;GLY A 282;VAL A  79","None","0.71A","1d4yB-3ianA:undetectable","1d4yB-3ianA:13.93"],["1IKV_A_EFZA2000_1","POL POLYPROTEIN","3ian","CHITINASE","Lactococcus lactis",5,"LEU A 283;TYR A 344;GLY A 317;LEU A 257;TYR A 228","None;EDO A 362 (-4.7A);None;None;None","1.39A","1ikvA-3ianA:undetectable","1ikvA-3ianA:20.69"],["1IKW_A_EFZA2000_1","POL POLYPROTEIN","3ian","CHITINASE","Lactococcus lactis",5,"LEU A 283;TYR A 344;GLY A 317;LEU A 257;TYR A 228","None;EDO A 362 (-4.7A);None;None;None","1.43A","1ikwA-3ianA:undetectable","1ikwA-3ianA:20.87"],["1OIP_A_VIVA1278_1","ALPHA-TOCOPHEROL TRANSFER PROTEIN","3ian","CHITINASE","Lactococcus lactis",4,"SER A 285;PHE A  68;VAL A 341;PHE A 340","None;EDO A 364 ( 3.5A);None;None","1.47A","1oipA-3ianA:2.6","1oipA-3ianA:17.21"],["1TDR_B_MTXB170_1","TELLUROMETHIONYL DIHYDROFOLATE REDUCTASE","3ian","CHITINASE","Lactococcus lactis",5,"ALA A 198;ASP A 158;LEU A 157;ILE A 131;TYR A 203","EDO A 361 ( 4.7A);None;None;None;None","1.50A","1tdrB-3ianA:undetectable","1tdrB-3ianA:16.26"],["1W5U_A_DVAA6_0","GRAMICIDIN D","3ian","CHITINASE","Lactococcus lactis",3,"ALA A 327;VAL A 323;TRP A  49","EDO A 364 ( 4.2A);None;None","0.93A","1w5uA-3ianA:undetectable;1w5uB-3ianA:undetectable","1w5uA-3ianA:3.25;1w5uB-3ianA:3.25"],["1WG8_A_SAMA3142_1","PREDICTED S-ADENOSYLMETHIONINE-DEPENDENT METHYLTRANSFERASE","3ian","CHITINASE","Lactococcus lactis",4,"HIS A 358;ASP A 222;ASN A 225;ASP A 155"," NA A   1 ( 4.8A);EDO A 366 (-3.1A);None; NA A   1 ( 2.9A)","1.36A","1wg8A-3ianA:0.7","1wg8A-3ianA:23.12"],["1XOQ_A_ROFA502_1","CAMP-SPECIFIC 3',5'-CYCLIC PHOSPHODIESTERASE 4D","3ian","CHITINASE","Lactococcus lactis",3,"ASN A 324;TRP A  49;GLN A  74","None;None;EDO A 364 (-4.0A)","1.37A","1xoqA-3ianA:undetectable","1xoqA-3ianA:22.88"],["2A3B_B_CFFB2435_1","CHITINASE","3ian","CHITINASE","Lactococcus lactis",5,"PHE A  84;GLY A 126;ASP A 160;TYR A 229;TRP A 321","None;EDO A 369 ( 3.7A);EDO A 361 ( 2.7A);EDO A 361 (-4.5A);EDO A 361 (-4.5A)","0.92A","2a3bB-3ianA:21.7","2a3bB-3ianA:24.28"],["2A3C_A_PNXA1434_1","CHITINASE","3ian","CHITINASE","Lactococcus lactis",7,"TYR A  48;TRP A  52;PHE A  84;GLY A 126;ASP A 160;TYR A 229;TRP A 321","EDO A 361 ( 4.2A);None;None;EDO A 369 ( 3.7A);EDO A 361 ( 2.7A);EDO A 361 (-4.5A);EDO A 361 (-4.5A)","1.03A","2a3cA-3ianA:21.7","2a3cA-3ianA:24.28"],["2A3C_B_PNXB2433_1","CHITINASE","3ian","CHITINASE","Lactococcus lactis",6,"TRP A  52;PHE A  84;GLY A 126;ASP A 160;TYR A 229;TRP A 321","None;None;EDO A 369 ( 3.7A);EDO A 361 ( 2.7A);EDO A 361 (-4.5A);EDO A 361 (-4.5A)","0.99A","2a3cB-3ianA:21.8","2a3cB-3ianA:24.28"],["2AOJ_C_FRDC305_1","POL POLYPROTEIN;PEPTIDE INHIBITOR","3ian","CHITINASE","Lactococcus lactis",4,"LEU A 121;ASP A 158;GLY A 282;VAL A  79","None","0.84A","2aojA-3ianA:undetectable","2aojA-3ianA:13.93"],["2AVV_A_MK1A901_2","POL POLYPROTEIN","3ian","CHITINASE","Lactococcus lactis",3,"ASP A 155;VAL A  82;PRO A  98"," NA A   1 ( 2.9A);None;None","0.71A","2avvA-3ianA:undetectable","2avvA-3ianA:13.93"],["2FK8_A_SAMA302_1","METHOXY MYCOLIC ACID SYNTHASE 4","3ian","CHITINASE","Lactococcus lactis",3,"SER A 239;THR A 266;GLN A 262","None","0.76A","2fk8A-3ianA:undetectable","2fk8A-3ianA:21.64"],["2IZQ_D_DVAD6_0","GRAMICIDIN D","3ian","CHITINASE","Lactococcus lactis",3,"TRP A  49;ALA A 327;VAL A 323","None;EDO A 364 ( 4.2A);None","0.95A","2izqC-3ianA:undetectable;2izqD-3ianA:undetectable","2izqC-3ianA:3.25;2izqD-3ianA:3.25"],["2PKM_A_ADNA501_1","ADENOSINE KINASE","3ian","CHITINASE","Lactococcus lactis",5,"ALA A 327;GLY A 328;PHE A  68;GLY A  56;ASP A  58","EDO A 364 ( 4.2A);None;EDO A 364 ( 3.5A);None;None","0.93A","2pkmA-3ianA:undetectable","2pkmA-3ianA:21.45"],["2PO5_B_CHDB501_0","FERROCHELATASE, MITOCHONDRIAL","3ian","CHITINASE","Lactococcus lactis",5,"LEU A 305;LEU A 348;MET A 347;VAL A 341;VAL A 295","None","1.34A","2po5B-3ianA:undetectable","2po5B-3ianA:19.68"],["2QX4_B_ML1B233_1","RIBOSYLDIHYDRONICOTINAMIDE DEHYDROGENASE [QUINONE];RIBOSYLDIHYDRONICOTINAMIDE DEHYDROGENASE [QUINONE]","3ian","CHITINASE","Lactococcus lactis",4,"GLY A 232;THR A 292;GLN A 231;PHE A 201","None","1.03A","2qx4A-3ianA:undetectable;2qx4B-3ianA:undetectable","2qx4A-3ianA:23.31;2qx4B-3ianA:23.31"],["2UY4_A_AZMA1311_1","ENDOCHITINASE","3ian","CHITINASE","Lactococcus lactis",5,"TYR A  48;PHE A  84;GLY A 125;ASP A 160;GLN A 227","EDO A 361 ( 4.2A);None;None;EDO A 361 ( 2.7A);EDO A 369 ( 3.3A)","1.11A","2uy4A-3ianA:23.8","2uy4A-3ianA:24.71"],["2UY4_A_AZMA1311_1","ENDOCHITINASE","3ian","CHITINASE","Lactococcus lactis",5,"TYR A  48;PHE A  84;GLY A 126;ALA A 127;TRP A 321","EDO A 361 ( 4.2A);None;EDO A 369 ( 3.7A);EDO A 369 (-4.5A);EDO A 361 (-4.5A)","0.71A","2uy4A-3ianA:23.8","2uy4A-3ianA:24.71"],["2UY4_A_AZMA1311_1","ENDOCHITINASE","3ian","CHITINASE","Lactococcus lactis",7,"TYR A  48;PHE A  84;GLY A 126;ASP A 160;GLN A 227;TYR A 229;TRP A 321","EDO A 361 ( 4.2A);None;EDO A 369 ( 3.7A);EDO A 361 ( 2.7A);EDO A 369 ( 3.3A);EDO A 361 (-4.5A);EDO A 361 (-4.5A)","0.35A","2uy4A-3ianA:23.8","2uy4A-3ianA:24.71"],["2VQ5_B_LDPB1197_1","S-NORCOCLAURINE SYNTHASE","3ian","CHITINASE","Lactococcus lactis",4,"LEU A 318;LEU A 283;LEU A 348;PRO A 298","None;None;None;EDO A 362 (-4.1A)","0.89A","2vq5B-3ianA:undetectable","2vq5B-3ianA:18.84"],["2X45_B_HSMB1162_1","ALLERGEN ARG R 1","3ian","CHITINASE","Lactococcus lactis",3,"GLU A 314;HIS A 354;GLU A 352","None","0.82A","2x45B-3ianA:undetectable","2x45B-3ianA:19.81"],["2X45_C_HSMC1162_1","ALLERGEN ARG R 1","3ian","CHITINASE","Lactococcus lactis",3,"GLU A 314;HIS A 354;GLU A 352","None","0.82A","2x45C-3ianA:undetectable","2x45C-3ianA:19.81"],["2XTK_A_AZMA1339_1","CLASS III CHITINASE CHIA1","3ian","CHITINASE","Lactococcus lactis",10,"TYR A  48;PHE A  84;GLY A 126;ALA A 127;ASP A 160;GLN A 227;TYR A 229;ASN A 230;ALA A 290;TRP A 321","EDO A 361 ( 4.2A);None;EDO A 369 ( 3.7A);EDO A 369 (-4.5A);EDO A 361 ( 2.7A);EDO A 369 ( 3.3A);EDO A 361 (-4.5A);None;None;EDO A 361 (-4.5A)","0.67A","2xtkA-3ianA:23.6","2xtkA-3ianA:23.93"],["2XTK_A_AZMA1339_1","CLASS III CHITINASE CHIA1","3ian","CHITINASE","Lactococcus lactis",6,"TYR A  48;PHE A  84;GLY A 126;ASP A 160;ALA A 289;TRP A 321","EDO A 361 ( 4.2A);None;EDO A 369 ( 3.7A);EDO A 361 ( 2.7A);None;EDO A 361 (-4.5A)","1.09A","2xtkA-3ianA:23.6","2xtkA-3ianA:23.93"],["2XTK_B_AZMB1339_1","CLASS III CHITINASE CHIA1","3ian","CHITINASE","Lactococcus lactis",7,"TYR A  48;PHE A  84;GLY A 126;ALA A 127;ASP A 160;GLN A 227;TRP A 321","EDO A 361 ( 4.2A);None;EDO A 369 ( 3.7A);EDO A 369 (-4.5A);EDO A 361 ( 2.7A);EDO A 369 ( 3.3A);EDO A 361 (-4.5A)","0.75A","2xtkB-3ianA:23.7","2xtkB-3ianA:23.93"],["2XTK_B_AZMB1339_1","CLASS III CHITINASE CHIA1","3ian","CHITINASE","Lactococcus lactis",7,"TYR A  48;PHE A  84;GLY A 126;ASP A 160;GLN A 227;TYR A 229;TRP A 321","EDO A 361 ( 4.2A);None;EDO A 369 ( 3.7A);EDO A 361 ( 2.7A);EDO A 369 ( 3.3A);EDO A 361 (-4.5A);EDO A 361 (-4.5A)","0.48A","2xtkB-3ianA:23.7","2xtkB-3ianA:23.93"],["3ADS_A_IMNA2_2","PEROXISOME PROLIFERATOR-ACTIVATED RECEPTOR GAMMA","3ian","CHITINASE","Lactococcus lactis",4,"ILE A 281;ILE A 214;TYR A 210;LEU A 283","None","0.72A","3adsA-3ianA:undetectable","3adsA-3ianA:19.48"],["3G6M_A_CFFA1_1","CHITINASE","3ian","CHITINASE","Lactococcus lactis",6,"TYR A  48;PHE A  84;GLY A 126;ASP A 160;TYR A 229;TRP A 321","EDO A 361 ( 4.2A);None;EDO A 369 ( 3.7A);EDO A 361 ( 2.7A);EDO A 361 (-4.5A);EDO A 361 (-4.5A)","1.00A","3g6mA-3ianA:21.2","3g6mA-3ianA:24.70"],["3HVT_A_NVPA557_1","HIV-1 REVERSE TRANSCRIPTASE (SUBUNIT P66)","3ian","CHITINASE","Lactococcus lactis",5,"LEU A 283;TYR A 344;GLY A 317;LEU A 257;TYR A 228","None;EDO A 362 (-4.7A);None;None;None","1.30A","3hvtA-3ianA:undetectable","3hvtA-3ianA:21.10"],["3VKX_A_T3A301_1","PROLIFERATING CELL NUCLEAR ANTIGEN","3ian","CHITINASE","Lactococcus lactis",4,"LEU A 260;PRO A 202;GLN A 231;TYR A 228","None","1.48A","3vkxA-3ianA:undetectable","3vkxA-3ianA:23.60"],["3W1W_A_CHDA1502_0","FERROCHELATASE, MITOCHONDRIAL","3ian","CHITINASE","Lactococcus lactis",5,"LEU A 305;LEU A 348;MET A 347;VAL A 341;VAL A 295","None","1.28A","3w1wA-3ianA:undetectable","3w1wA-3ianA:19.22"],["3WQV_A_GCSA501_1","CHITINASE","3ian","CHITINASE","Lactococcus lactis",5,"PHE A  84;GLY A 126;ASP A 160;TYR A 229;TRP A 321","None;EDO A 369 ( 3.7A);EDO A 361 ( 2.7A);EDO A 361 (-4.5A);EDO A 361 (-4.5A)","0.55A","3wqvA-3ianA:21.3","3wqvA-3ianA:25.84"],["3WQW_A_GCSA501_1","CHITINASE","3ian","CHITINASE","Lactococcus lactis",5,"PHE A  84;GLY A 126;ASP A 160;TYR A 229;TRP A 321","None;EDO A 369 ( 3.7A);EDO A 361 ( 2.7A);EDO A 361 (-4.5A);EDO A 361 (-4.5A)","0.56A","3wqwA-3ianA:21.2","3wqwA-3ianA:25.84"],["4KN2_C_LYAC304_2","FOLATE RECEPTOR BETA","3ian","CHITINASE","Lactococcus lactis",3,"TYR A  60;GLN A 247;TRP A 321","None;None;EDO A 361 (-4.5A)","0.85A","4kn2C-3ianA:undetectable","4kn2C-3ianA:22.40"],["4Z4H_A_IPHA904_0","PROTEIN ARGONAUTE-2","3ian","CHITINASE","Lactococcus lactis",4,"GLN A 227;PRO A 199;ILE A 159;ASP A 158","EDO A 369 ( 3.3A);None;None;None","1.40A","4z4hA-3ianA:undetectable","4z4hA-3ianA:16.84"],["5GQB_A_GCSA603_1","CHITINASE","3ian","CHITINASE","Lactococcus lactis",4,"PHE A  84;GLY A 126;TYR A 229;TRP A 321","None;EDO A 369 ( 3.7A);EDO A 361 (-4.5A);EDO A 361 (-4.5A)","0.46A","5gqbA-3ianA:10.2","5gqbA-3ianA:19.46"],["5IEN_B_VDYB201_1","CDL2.2","3ian","CHITINASE","Lactococcus lactis",5,"ILE A 145;LEU A 179;ILE A 131;LEU A 161;PRO A 199","None","1.12A","5ienB-3ianA:undetectable","5ienB-3ianA:21.81"],["5UIH_A_8CVA201_1","DIHYDROFOLATE REDUCTASE","3ian","CHITINASE","Lactococcus lactis",4,"ALA A 198;ASP A 158;LEU A 121;TYR A 229","EDO A 361 ( 4.7A);None;None;EDO A 361 (-4.5A)","0.87A","5uihA-3ianA:undetectable","5uihA-3ianA:13.80"],["5X7P_A_ACRA1431_1","GLYCOSIDE HYDROLASE FAMILY 31 ALPHA-GLUCOSIDASE","3ian","CHITINASE","Lactococcus lactis",4,"ASN A 225;ASP A 158;GLY A 156;ASN A  81","None","1.12A","5x7pA-3ianA:undetectable","5x7pA-3ianA:13.05"],["6BSJ_A_EFZA601_1","REVERSE TRANSCRIPTASE P66 SUBUNIT","3ian","CHITINASE","Lactococcus lactis",5,"LEU A 283;TYR A 344;GLY A 317;LEU A 257;TYR A 228","None;EDO A 362 (-4.7A);None;None;None","1.35A","6bsjA-3ianA:undetectable","6bsjA-3ianA:14.93"],["6GQI_A_ACTA604_0","CYCLOHEXANONE MONOOXYGENASE FROM THERMOCRISPUM MUNICIPALE","3ian","CHITINASE","Lactococcus lactis",4,"PRO A 212;ILE A 166;GLY A 208;TYR A 210","None","1.05A","6gqiA-3ianA:undetectable","6gqiA-3ianA:19.96"]]