SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3lkb'

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.	1DED_B_QPSB1501_2 (CYCLODEXTRIN GLUCANOTRANSFERASE)	3lkb	PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN (Thermus thermophilus)	5 / 9	TYR A 383 HIS A 107 LEU A 110 ASP A 112 ASN A 87	None	1.45A	1dedB-3lkbA: 0.5	1dedB-3lkbA: 19.25
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.	1FK9_A_EFZA999_1 (HIV-1 RT, A-CHAIN)	3lkb	PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN (Thermus thermophilus)	5 / 10	LEU A 223 LYS A 224 VAL A 199 GLY A 198 LEU A 191	None	1.44A	1fk9A-3lkbA: undetectable	1fk9A-3lkbA: 22.69
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.	1HSG_B_MK1B902_1 (HIV-1 PROTEASE)	3lkb	PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN (Thermus thermophilus)	5 / 10	ALA A 167 VAL A 146 ILE A 137 VAL A 177 ILE A 174	None	0.75A	1hsgA-3lkbA: undetectable	1hsgA-3lkbA: 14.48
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.	1HXB_A_ROCA100_3 (HIV-1 PROTEASE)	3lkb	PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN (Thermus thermophilus)	5 / 12	ALA A 167 VAL A 146 ILE A 137 VAL A 177 ILE A 174	None	0.78A	1hxbB-3lkbA: undetectable	1hxbB-3lkbA: 14.75
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.	1LQT_B_ACTB1867_0 (FPRA)	3lkb	PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN (Thermus thermophilus)	4 / 4	ALA A 304 ARG A 307 GLN A 305 GLU A 306	None	1.27A	1lqtB-3lkbA: 4.5	1lqtB-3lkbA: 22.55
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.	1LQU_B_ACTB1424_0 (FPRA)	3lkb	PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN (Thermus thermophilus)	4 / 4	ALA A 304 ARG A 307 GLN A 305 GLU A 306	None	1.24A	1lquB-3lkbA: 4.2	1lquB-3lkbA: 22.55
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.	1MCN_P_DHIP1_0 (IMMUNOGLOBULIN LAMBDA DIMER MCG (LIGHT CHAIN) PEPTIDE N-ACETYL-D-HIS-L-PRO -NH2)	3lkb	PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN (Thermus thermophilus)	3 / 3	PHE A 329 TYR A 34 PRO A 331	None	1.12A	1mcnA-3lkbA: undetectable 1mcnB-3lkbA: undetectable 1mcnP-3lkbA: undetectable	1mcnA-3lkbA: 21.28 1mcnB-3lkbA: 21.28 1mcnP-3lkbA: 1.31
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.	1PJ7_A_FFOA2887_1 (N,N-DIMETHYLGLYCINE OXIDASE)	3lkb	PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN (Thermus thermophilus)	3 / 3	ASP A 344 THR A 351 GLU A 128	NA A 394 (-3.1A) None None	0.83A	1pj7A-3lkbA: 4.5	1pj7A-3lkbA: 19.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.	2BPX_B_MK1B902_2 (HIV-1 PROTEASE)	3lkb	PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN (Thermus thermophilus)	5 / 12	ALA A 167 VAL A 146 ILE A 137 VAL A 177 ILE A 174	None	0.78A	2bpxB-3lkbA: undetectable	2bpxB-3lkbA: 14.48
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.	2O4L_A_TPVA403_2 (PROTEASE)	3lkb	PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN (Thermus thermophilus)	5 / 12	ALA A 167 VAL A 146 ILE A 137 VAL A 177 ILE A 174	None	0.79A	2o4lB-3lkbA: undetectable	2o4lB-3lkbA: 14.75
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.	2Q63_A_1UNA1001_1 (PROTEASE RETROPEPSIN)	3lkb	PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN (Thermus thermophilus)	5 / 12	ALA A 167 VAL A 146 ILE A 137 VAL A 177 ILE A 174	None	0.86A	2q63A-3lkbA: undetectable	2q63A-3lkbA: 14.75
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_3 (PROTEASE RETROPEPSIN)	3lkb	PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN (Thermus thermophilus)	5 / 12	ALA A 167 VAL A 146 ILE A 137 VAL A 177 ILE A 174	None	0.79A	2q64B-3lkbA: undetectable	2q64B-3lkbA: 14.75
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.	3EKX_B_1UNB201_2 (PROTEASE)	3lkb	PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN (Thermus thermophilus)	5 / 11	ALA A 167 VAL A 146 ILE A 137 VAL A 177 ILE A 174	None	0.73A	3ekxB-3lkbA: undetectable	3ekxB-3lkbA: 14.75
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.	3EL1_A_DR7A100_2 (PROTEASE)	3lkb	PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN (Thermus thermophilus)	5 / 12	ALA A 167 VAL A 146 ILE A 137 VAL A 177 ILE A 174	None	0.78A	3el1B-3lkbA: undetectable	3el1B-3lkbA: 15.01
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.	3FC6_C_REAC501_1 (RETINOIC ACID RECEPTOR RXR-ALPHA)	3lkb	PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN (Thermus thermophilus)	5 / 12	VAL A 160 ALA A 166 ALA A 167 LEU A 172 VAL A 150	None	0.97A	3fc6C-3lkbA: undetectable	3fc6C-3lkbA: 21.30
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.	3GWX_A_EPAA1_2 (PROTEIN (PEROXISOME PROLIFERATOR ACTIVATED RECEPTOR (PPAR-DELTA)))	3lkb	PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN (Thermus thermophilus)	5 / 12	THR A 124 THR A 253 ILE A 296 ILE A 343 TYR A 27	None	1.34A	3gwxA-3lkbA: undetectable	3gwxA-3lkbA: 24.62
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.	3K4V_B_ROCB201_3 (HIV-1 PROTEASE)	3lkb	PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN (Thermus thermophilus)	5 / 12	ALA A 167 VAL A 146 ILE A 137 VAL A 177 ILE A 174	None	0.82A	3k4vB-3lkbA: undetectable	3k4vB-3lkbA: 15.01
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.	3K4V_D_ROCD201_1 (HIV-1 PROTEASE)	3lkb	PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN (Thermus thermophilus)	5 / 12	ALA A 167 VAL A 146 ILE A 137 VAL A 177 ILE A 174	None	0.80A	3k4vC-3lkbA: undetectable	3k4vC-3lkbA: 15.01
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.	3NU6_B_478B401_1 (PROTEASE)	3lkb	PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN (Thermus thermophilus)	5 / 10	ALA A 167 VAL A 146 ILE A 137 VAL A 177 ILE A 174	None	0.99A	3nu6A-3lkbA: undetectable	3nu6A-3lkbA: 16.09
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.	3OXC_A_ROCA401_1 (PROTEASE)	3lkb	PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN (Thermus thermophilus)	5 / 12	ALA A 167 VAL A 146 ILE A 137 VAL A 177 ILE A 174	None	0.77A	3oxcA-3lkbA: undetectable	3oxcA-3lkbA: 15.01
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.	3ROD_A_NCAA302_0 (NICOTINAMIDE N-METHYLTRANSFERASE)	3lkb	PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN (Thermus thermophilus)	4 / 8	TYR A 82 ASP A 237 ALA A 208 TYR A 232	VAL A 393 (-3.9A) None None VAL A 393 (-4.0A)	1.06A	3rodA-3lkbA: undetectable	3rodA-3lkbA: 22.25
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.	3T8N_D_EDTD135_0 (STEROID DELTA-ISOMERASE)	3lkb	PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN (Thermus thermophilus)	5 / 11	ARG A 266 GLY A 332 PRO A 331 PRO A 263 ASP A 261	None	1.49A	3t8nD-3lkbA: undetectable 3t8nF-3lkbA: undetectable	3t8nD-3lkbA: 16.89 3t8nF-3lkbA: 16.89
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.	3TKW_B_017B401_2 (PROTEASE)	3lkb	PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN (Thermus thermophilus)	5 / 12	ALA A 167 VAL A 146 ILE A 137 VAL A 177 ILE A 174	None	0.86A	3tkwB-3lkbA: undetectable	3tkwB-3lkbA: 15.32
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.	3TL9_A_ROCA401_3 (PROTEASE)	3lkb	PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN (Thermus thermophilus)	5 / 12	ALA A 167 VAL A 146 ILE A 137 VAL A 177 ILE A 174	None	0.85A	3tl9B-3lkbA: undetectable	3tl9B-3lkbA: 15.32
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.	3VRM_A_VD3A502_1 (VITAMIN D(3) 25-HYDROXYLASE)	3lkb	PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN (Thermus thermophilus)	5 / 12	ILE A 301 ILE A 320 ALA A 319 PRO A 77 ILE A 76	None	0.96A	3vrmA-3lkbA: undetectable	3vrmA-3lkbA: 27.67
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.	4M6T_A_SAMA201_0 (RNA POLYMERASE II-ASSOCIATED FACTOR 1 HOMOLOG, LINKER, RNA POLYMERASE-ASSOCIATE D PROTEIN LEO1)	3lkb	PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN (Thermus thermophilus)	4 / 4	ILE A 301 VAL A 48 VAL A 44 ARG A 302	None	1.01A	4m6tA-3lkbA: undetectable	4m6tA-3lkbA: 19.28
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.	4OLB_A_TRPA901_0 (PROTEIN ARGONAUTE-2)	3lkb	PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN (Thermus thermophilus)	3 / 3	VAL A 203 ALA A 230 PHE A 249	None	0.90A	4olbA-3lkbA: 5.7	4olbA-3lkbA: 18.10
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.	4PCL_B_SAMB301_0 (O-METHYLTRANSFERASE FAMILY PROTEIN)	3lkb	PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN (Thermus thermophilus)	5 / 12	PHE A 67 ALA A 23 ALA A 104 ASN A 289 TYR A 232	None None VAL A 393 (-3.4A) None VAL A 393 (-4.0A)	1.27A	4pclB-3lkbA: 4.0	4pclB-3lkbA: 19.39
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.	4PGF_B_ADNB502_1 (ADENOSYLHOMOCYSTEINA SE)	3lkb	PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN (Thermus thermophilus)	5 / 12	GLU A 200 GLU A 140 LEU A 170 LEU A 172 GLY A 143	None	1.36A	4pgfB-3lkbA: 3.7	4pgfB-3lkbA: 20.75
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.	4QGI_A_ROCA101_2 (PROTEASE)	3lkb	PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN (Thermus thermophilus)	5 / 11	ALA A 167 VAL A 146 ILE A 137 VAL A 177 ILE A 174	None	0.75A	4qgiB-3lkbA: undetectable	4qgiB-3lkbA: 13.94
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.	4Z4F_A_IPHA903_0 (PROTEIN ARGONAUTE-2)	3lkb	PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN (Thermus thermophilus)	4 / 4	VAL A 203 ALA A 230 PHE A 249 THR A 233	None	1.27A	4z4fA-3lkbA: 5.9	4z4fA-3lkbA: 18.10
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.	5NN6_A_MIGA1013_1 (LYSOSOMAL ALPHA-GLUCOSIDASE)	3lkb	PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN (Thermus thermophilus)	5 / 12	LEU A 121 ILE A 111 ASP A 112 ASP A 162 PHE A 378	None	1.39A	5nn6A-3lkbA: undetectable	5nn6A-3lkbA: 17.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.	5NN8_A_ACRA1015_1 (LYSOSOMAL ALPHA-GLUCOSIDASE)	3lkb	PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN (Thermus thermophilus)	5 / 12	LEU A 121 ILE A 111 ASP A 112 ASP A 162 PHE A 378	None	1.37A	5nn8A-3lkbA: undetectable	5nn8A-3lkbA: 17.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.	5UUN_B_ACTB309_0 (GLUTATHIONE S-TRANSFERASE-LIKE PROTEIN)	3lkb	PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN (Thermus thermophilus)	3 / 3	TYR A 58 ALA A 104 TYR A 82	VAL A 393 (-4.6A) VAL A 393 (-3.4A) VAL A 393 (-3.9A)	0.86A	5uunB-3lkbA: undetectable	5uunB-3lkbA: 26.02
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.	5XXI_A_LSNA503_1 (CYTOCHROME P450 2C9)	3lkb	PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN (Thermus thermophilus)	5 / 12	ILE A 111 LEU A 90 PHE A 79 PRO A 103 LEU A 121	None	1.21A	5xxiA-3lkbA: undetectable	5xxiA-3lkbA: 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.	5Y2T_B_8LXB501_1 (PEROXISOME PROLIFERATOR-ACTIVAT ED RECEPTOR GAMMA)	3lkb	PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN (Thermus thermophilus)	4 / 8	GLU A 109 HIS A 382 SER A 375 LEU A 170	None	0.80A	5y2tB-3lkbA: undetectable	5y2tB-3lkbA: 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.	6DIF_B_TPVB201_1 (HIV-1 PROTEASE)	3lkb	PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN (Thermus thermophilus)	5 / 12	ALA A 167 VAL A 146 ILE A 137 VAL A 177 ILE A 174	None	0.81A	6difB-3lkbA: undetectable	6difB-3lkbA: 12.16
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.	6DIL_B_TPVB201_1 (HIV-1 PROTEASE)	3lkb	PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN (Thermus thermophilus)	5 / 12	ALA A 167 VAL A 146 ILE A 137 VAL A 177 ILE A 174	None	0.81A	6dilB-3lkbA: undetectable	6dilB-3lkbA: 12.16
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.	6EBP_D_DAHD123_0 (RIBONUCLEOSIDE-DIPHO SPHATE REDUCTASE, BETA SUBUNIT)	3lkb	PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN (Thermus thermophilus)	5 / 10	PHE A 67 THR A 63 SER A 81 PHE A 11 ILE A 94	None	1.09A	6ebpD-3lkbA: undetectable	6ebpD-3lkbA: 11.20
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.	6EKZ_A_SNPA414_0 (AROMATIC PEROXYGENASE)	3lkb	PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN (Thermus thermophilus)	4 / 5	PHE A 67 VAL A 31 PRO A 77 VAL A 71	None	1.04A	6ekzA-3lkbA: undetectable	6ekzA-3lkbA: 13.60
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.	6GP2_B_DAHB126_0 (RIBONUCLEOSIDE-DIPHO SPHATE REDUCTASE BETA CHAIN)	3lkb	PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN (Thermus thermophilus)	5 / 11	PHE A 67 THR A 63 SER A 81 PHE A 11 ILE A 94	None	1.04A	6gp2B-3lkbA: undetectable	6gp2B-3lkbA: 12.30
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.	6JI6_A_ACTA305_0 (GLUTATHIONE S-TRANSFERASE CLASS-MU 26 KDA ISOZYME)	3lkb	PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN (Thermus thermophilus)	4 / 5	GLY A 85 LEU A 88 SER A 105 TYR A 126	None None VAL A 393 (-3.4A) VAL A 393 (-4.8A)	1.29A	6ji6A-3lkbA: undetectable	6ji6A-3lkbA: 21.01

[["DrReposER ID","Desc.","Hit PDB","Hit molecule","Hit organism","Res. no.","Interface","HETATM","RMSD","Z-score","Seq ID"],["1DED_B_QPSB1501_2","CYCLODEXTRIN GLUCANOTRANSFERASE","3lkb","PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN","Thermus thermophilus",5,"TYR A 383;HIS A 107;LEU A 110;ASP A 112;ASN A  87","None","1.45A","1dedB-3lkbA:0.5","1dedB-3lkbA:19.25"],["1FK9_A_EFZA999_1","HIV-1 RT, A-CHAIN","3lkb","PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN","Thermus thermophilus",5,"LEU A 223;LYS A 224;VAL A 199;GLY A 198;LEU A 191","None","1.44A","1fk9A-3lkbA:undetectable","1fk9A-3lkbA:22.69"],["1HSG_B_MK1B902_1","HIV-1 PROTEASE;HIV-1 PROTEASE","3lkb","PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN","Thermus thermophilus",5,"ALA A 167;VAL A 146;ILE A 137;VAL A 177;ILE A 174","None","0.75A","1hsgA-3lkbA:undetectable","1hsgA-3lkbA:14.48"],["1HXB_A_ROCA100_3","HIV-1 PROTEASE;HIV-1 PROTEASE","3lkb","PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN","Thermus thermophilus",5,"ALA A 167;VAL A 146;ILE A 137;VAL A 177;ILE A 174","None","0.78A","1hxbB-3lkbA:undetectable","1hxbB-3lkbA:14.75"],["1LQT_B_ACTB1867_0","FPRA","3lkb","PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN","Thermus thermophilus",4,"ALA A 304;ARG A 307;GLN A 305;GLU A 306","None","1.27A","1lqtB-3lkbA:4.5","1lqtB-3lkbA:22.55"],["1LQU_B_ACTB1424_0","FPRA","3lkb","PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN","Thermus thermophilus",4,"ALA A 304;ARG A 307;GLN A 305;GLU A 306","None","1.24A","1lquB-3lkbA:4.2","1lquB-3lkbA:22.55"],["1MCN_P_DHIP1_0","IMMUNOGLOBULIN LAMBDA DIMER MCG (LIGHT CHAIN);PEPTIDE N-ACETYL-D-HIS-L-PRO-NH2","3lkb","PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN","Thermus thermophilus",3,"PHE A 329;TYR A  34;PRO A 331","None","1.12A","1mcnA-3lkbA:undetectable;1mcnB-3lkbA:undetectable;1mcnP-3lkbA:undetectable","1mcnA-3lkbA:21.28;1mcnB-3lkbA:21.28;1mcnP-3lkbA:1.31"],["1PJ7_A_FFOA2887_1","N,N-DIMETHYLGLYCINE OXIDASE","3lkb","PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN","Thermus thermophilus",3,"ASP A 344;THR A 351;GLU A 128"," NA A 394 (-3.1A);None;None","0.83A","1pj7A-3lkbA:4.5","1pj7A-3lkbA:19.00"],["2BPX_B_MK1B902_2","HIV-1 PROTEASE","3lkb","PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN","Thermus thermophilus",5,"ALA A 167;VAL A 146;ILE A 137;VAL A 177;ILE A 174","None","0.78A","2bpxB-3lkbA:undetectable","2bpxB-3lkbA:14.48"],["2O4L_A_TPVA403_2","PROTEASE;PROTEASE","3lkb","PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN","Thermus thermophilus",5,"ALA A 167;VAL A 146;ILE A 137;VAL A 177;ILE A 174","None","0.79A","2o4lB-3lkbA:undetectable","2o4lB-3lkbA:14.75"],["2Q63_A_1UNA1001_1","PROTEASE RETROPEPSIN","3lkb","PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN","Thermus thermophilus",5,"ALA A 167;VAL A 146;ILE A 137;VAL A 177;ILE A 174","None","0.86A","2q63A-3lkbA:undetectable","2q63A-3lkbA:14.75"],["2Q64_B_1UNB1001_3","PROTEASE RETROPEPSIN","3lkb","PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN","Thermus thermophilus",5,"ALA A 167;VAL A 146;ILE A 137;VAL A 177;ILE A 174","None","0.79A","2q64B-3lkbA:undetectable","2q64B-3lkbA:14.75"],["3EKX_B_1UNB201_2","PROTEASE","3lkb","PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN","Thermus thermophilus",5,"ALA A 167;VAL A 146;ILE A 137;VAL A 177;ILE A 174","None","0.73A","3ekxB-3lkbA:undetectable","3ekxB-3lkbA:14.75"],["3EL1_A_DR7A100_2","PROTEASE;PROTEASE","3lkb","PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN","Thermus thermophilus",5,"ALA A 167;VAL A 146;ILE A 137;VAL A 177;ILE A 174","None","0.78A","3el1B-3lkbA:undetectable","3el1B-3lkbA:15.01"],["3FC6_C_REAC501_1","RETINOIC ACID RECEPTOR RXR-ALPHA","3lkb","PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN","Thermus thermophilus",5,"VAL A 160;ALA A 166;ALA A 167;LEU A 172;VAL A 150","None","0.97A","3fc6C-3lkbA:undetectable","3fc6C-3lkbA:21.30"],["3GWX_A_EPAA1_2","PROTEIN (PEROXISOME PROLIFERATOR ACTIVATED RECEPTOR (PPAR-DELTA))","3lkb","PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN","Thermus thermophilus",5,"THR A 124;THR A 253;ILE A 296;ILE A 343;TYR A  27","None","1.34A","3gwxA-3lkbA:undetectable","3gwxA-3lkbA:24.62"],["3K4V_B_ROCB201_3","HIV-1 PROTEASE","3lkb","PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN","Thermus thermophilus",5,"ALA A 167;VAL A 146;ILE A 137;VAL A 177;ILE A 174","None","0.82A","3k4vB-3lkbA:undetectable","3k4vB-3lkbA:15.01"],["3K4V_D_ROCD201_1","HIV-1 PROTEASE;HIV-1 PROTEASE","3lkb","PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN","Thermus thermophilus",5,"ALA A 167;VAL A 146;ILE A 137;VAL A 177;ILE A 174","None","0.80A","3k4vC-3lkbA:undetectable","3k4vC-3lkbA:15.01"],["3NU6_B_478B401_1","PROTEASE;PROTEASE","3lkb","PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN","Thermus thermophilus",5,"ALA A 167;VAL A 146;ILE A 137;VAL A 177;ILE A 174","None","0.99A","3nu6A-3lkbA:undetectable","3nu6A-3lkbA:16.09"],["3OXC_A_ROCA401_1","PROTEASE","3lkb","PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN","Thermus thermophilus",5,"ALA A 167;VAL A 146;ILE A 137;VAL A 177;ILE A 174","None","0.77A","3oxcA-3lkbA:undetectable","3oxcA-3lkbA:15.01"],["3ROD_A_NCAA302_0","NICOTINAMIDE N-METHYLTRANSFERASE","3lkb","PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN","Thermus thermophilus",4,"TYR A  82;ASP A 237;ALA A 208;TYR A 232","VAL A 393 (-3.9A);None;None;VAL A 393 (-4.0A)","1.06A","3rodA-3lkbA:undetectable","3rodA-3lkbA:22.25"],["3T8N_D_EDTD135_0","STEROID DELTA-ISOMERASE","3lkb","PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN","Thermus thermophilus",5,"ARG A 266;GLY A 332;PRO A 331;PRO A 263;ASP A 261","None","1.49A","3t8nD-3lkbA:undetectable;3t8nF-3lkbA:undetectable","3t8nD-3lkbA:16.89;3t8nF-3lkbA:16.89"],["3TKW_B_017B401_2","PROTEASE","3lkb","PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN","Thermus thermophilus",5,"ALA A 167;VAL A 146;ILE A 137;VAL A 177;ILE A 174","None","0.86A","3tkwB-3lkbA:undetectable","3tkwB-3lkbA:15.32"],["3TL9_A_ROCA401_3","PROTEASE;PROTEASE","3lkb","PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN","Thermus thermophilus",5,"ALA A 167;VAL A 146;ILE A 137;VAL A 177;ILE A 174","None","0.85A","3tl9B-3lkbA:undetectable","3tl9B-3lkbA:15.32"],["3VRM_A_VD3A502_1","VITAMIN D(3) 25-HYDROXYLASE","3lkb","PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN","Thermus thermophilus",5,"ILE A 301;ILE A 320;ALA A 319;PRO A  77;ILE A  76","None","0.96A","3vrmA-3lkbA:undetectable","3vrmA-3lkbA:27.67"],["4M6T_A_SAMA201_0","RNA POLYMERASE II-ASSOCIATED FACTOR 1 HOMOLOG, LINKER, RNA POLYMERASE-ASSOCIATED PROTEIN LEO1","3lkb","PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN","Thermus thermophilus",4,"ILE A 301;VAL A  48;VAL A  44;ARG A 302","None","1.01A","4m6tA-3lkbA:undetectable","4m6tA-3lkbA:19.28"],["4OLB_A_TRPA901_0","PROTEIN ARGONAUTE-2","3lkb","PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN","Thermus thermophilus",3,"VAL A 203;ALA A 230;PHE A 249","None","0.90A","4olbA-3lkbA:5.7","4olbA-3lkbA:18.10"],["4PCL_B_SAMB301_0","O-METHYLTRANSFERASE FAMILY PROTEIN","3lkb","PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN","Thermus thermophilus",5,"PHE A  67;ALA A  23;ALA A 104;ASN A 289;TYR A 232","None;None;VAL A 393 (-3.4A);None;VAL A 393 (-4.0A)","1.27A","4pclB-3lkbA:4.0","4pclB-3lkbA:19.39"],["4PGF_B_ADNB502_1","ADENOSYLHOMOCYSTEINASE","3lkb","PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN","Thermus thermophilus",5,"GLU A 200;GLU A 140;LEU A 170;LEU A 172;GLY A 143","None","1.36A","4pgfB-3lkbA:3.7","4pgfB-3lkbA:20.75"],["4QGI_A_ROCA101_2","PROTEASE;PROTEASE","3lkb","PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN","Thermus thermophilus",5,"ALA A 167;VAL A 146;ILE A 137;VAL A 177;ILE A 174","None","0.75A","4qgiB-3lkbA:undetectable","4qgiB-3lkbA:13.94"],["4Z4F_A_IPHA903_0","PROTEIN ARGONAUTE-2","3lkb","PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN","Thermus thermophilus",4,"VAL A 203;ALA A 230;PHE A 249;THR A 233","None","1.27A","4z4fA-3lkbA:5.9","4z4fA-3lkbA:18.10"],["5NN6_A_MIGA1013_1","LYSOSOMAL ALPHA-GLUCOSIDASE","3lkb","PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN","Thermus thermophilus",5,"LEU A 121;ILE A 111;ASP A 112;ASP A 162;PHE A 378","None","1.39A","5nn6A-3lkbA:undetectable","5nn6A-3lkbA:17.78"],["5NN8_A_ACRA1015_1","LYSOSOMAL ALPHA-GLUCOSIDASE","3lkb","PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN","Thermus thermophilus",5,"LEU A 121;ILE A 111;ASP A 112;ASP A 162;PHE A 378","None","1.37A","5nn8A-3lkbA:undetectable","5nn8A-3lkbA:17.78"],["5UUN_B_ACTB309_0","GLUTATHIONE S-TRANSFERASE-LIKE PROTEIN","3lkb","PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN","Thermus thermophilus",3,"TYR A  58;ALA A 104;TYR A  82","VAL A 393 (-4.6A);VAL A 393 (-3.4A);VAL A 393 (-3.9A)","0.86A","5uunB-3lkbA:undetectable","5uunB-3lkbA:26.02"],["5XXI_A_LSNA503_1","CYTOCHROME P450 2C9","3lkb","PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN","Thermus thermophilus",5,"ILE A 111;LEU A  90;PHE A  79;PRO A 103;LEU A 121","None","1.21A","5xxiA-3lkbA:undetectable","5xxiA-3lkbA:20.45"],["5Y2T_B_8LXB501_1","PEROXISOME PROLIFERATOR-ACTIVATED RECEPTOR GAMMA","3lkb","PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN","Thermus thermophilus",4,"GLU A 109;HIS A 382;SER A 375;LEU A 170","None","0.80A","5y2tB-3lkbA:undetectable","5y2tB-3lkbA:undetectable"],["6DIF_B_TPVB201_1","HIV-1 PROTEASE","3lkb","PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN","Thermus thermophilus",5,"ALA A 167;VAL A 146;ILE A 137;VAL A 177;ILE A 174","None","0.81A","6difB-3lkbA:undetectable","6difB-3lkbA:12.16"],["6DIL_B_TPVB201_1","HIV-1 PROTEASE","3lkb","PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN","Thermus thermophilus",5,"ALA A 167;VAL A 146;ILE A 137;VAL A 177;ILE A 174","None","0.81A","6dilB-3lkbA:undetectable","6dilB-3lkbA:12.16"],["6EBP_D_DAHD123_0","RIBONUCLEOSIDE-DIPHOSPHATE REDUCTASE, BETA SUBUNIT","3lkb","PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN","Thermus thermophilus",5,"PHE A  67;THR A  63;SER A  81;PHE A  11;ILE A  94","None","1.09A","6ebpD-3lkbA:undetectable","6ebpD-3lkbA:11.20"],["6EKZ_A_SNPA414_0","AROMATIC PEROXYGENASE","3lkb","PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN","Thermus thermophilus",4,"PHE A  67;VAL A  31;PRO A  77;VAL A  71","None","1.04A","6ekzA-3lkbA:undetectable","6ekzA-3lkbA:13.60"],["6GP2_B_DAHB126_0","RIBONUCLEOSIDE-DIPHOSPHATE REDUCTASE BETA CHAIN","3lkb","PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN","Thermus thermophilus",5,"PHE A  67;THR A  63;SER A  81;PHE A  11;ILE A  94","None","1.04A","6gp2B-3lkbA:undetectable","6gp2B-3lkbA:12.30"],["6JI6_A_ACTA305_0","GLUTATHIONE S-TRANSFERASE CLASS-MU 26 KDA ISOZYME","3lkb","PROBABLE BRANCHED-CHAIN AMINO ACID ABC TRANSPORTER, AMINO ACID BINDING PROTEIN","Thermus thermophilus",4,"GLY A  85;LEU A  88;SER A 105;TYR A 126","None;None;VAL A 393 (-3.4A);VAL A 393 (-4.8A)","1.29A","6ji6A-3lkbA:undetectable","6ji6A-3lkbA:21.01"]]