SIMILAR PATTERN OF AMINO ACIDS MAPPED TO 'ESL'

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 (%)
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.	1EA1_A_TPFA470_1 (CYTOCHROME P450 51-LIKE RV0764C)	1x8v	CYTOCHROME P450 51 (Mycobacterium tuberculosis)	4 / 8	PHE A 78 MET A 79 ARG A 96 PHE A 255	ESL A 471 ( 4.9A) ESL A 471 ( 4.4A) ESL A 471 (-3.6A) None	0.80A	1ea1A-1x8vA: 61.2	1ea1A-1x8vA: 99.56
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.	1EA1_A_TPFA470_1 (CYTOCHROME P450 51-LIKE RV0764C)	1x8v	CYTOCHROME P450 51 (Mycobacterium tuberculosis)	6 / 8	TYR A 76 PHE A 78 MET A 79 PHE A 255 THR A 260 LEU A 321	ESL A 471 ( 3.8A) ESL A 471 ( 4.9A) ESL A 471 ( 4.4A) None HEM A 470 (-3.6A) HEM A 470 (-4.1A)	0.52A	1ea1A-1x8vA: 61.2	1ea1A-1x8vA: 99.56
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.	2WUZ_A_TPFA1460_1 (LANOSTEROL 14-ALPHA-DEMETHYLASE , PUTATIVE)	1x8v	CYTOCHROME P450 51 (Mycobacterium tuberculosis)	5 / 10	MET A 79 PHE A 83 ALA A 256 THR A 260 LEU A 321	ESL A 471 ( 4.4A) None ESL A 471 ( 3.4A) HEM A 470 (-3.6A) HEM A 470 (-4.1A)	1.06A	2wuzA-1x8vA: 39.7	2wuzA-1x8vA: 32.11
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.	2WUZ_B_TPFB1460_1 (LANOSTEROL 14-ALPHA-DEMETHYLASE , PUTATIVE)	1x8v	CYTOCHROME P450 51 (Mycobacterium tuberculosis)	5 / 10	MET A 79 PHE A 83 ALA A 256 THR A 260 LEU A 321	ESL A 471 ( 4.4A) None ESL A 471 ( 3.4A) HEM A 470 (-3.6A) HEM A 470 (-4.1A)	1.07A	2wuzB-1x8vA: 39.6	2wuzB-1x8vA: 32.11
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.	2WX2_A_TPFA1460_1 (LANOSTEROL 14-ALPHA-DEMETHYLASE)	1x8v	CYTOCHROME P450 51 (Mycobacterium tuberculosis)	5 / 7	MET A 79 PHE A 83 ALA A 256 THR A 260 LEU A 321	ESL A 471 ( 4.4A) None ESL A 471 ( 3.4A) HEM A 470 (-3.6A) HEM A 470 (-4.1A)	0.95A	2wx2A-1x8vA: 37.9	2wx2A-1x8vA: 32.11
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.	2X2N_A_X2NA1480_1 (LANOSTEROL 14-ALPHA-DEMETHYLASE)	1x8v	CYTOCHROME P450 51 (Mycobacterium tuberculosis)	5 / 12	TYR A 76 MET A 79 ALA A 256 THR A 260 MET A 325	ESL A 471 ( 3.8A) ESL A 471 ( 4.4A) ESL A 471 ( 3.4A) HEM A 470 (-3.6A) None	1.04A	2x2nA-1x8vA: 37.7	2x2nA-1x8vA: 31.90
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.	2X2N_A_X2NA1480_1 (LANOSTEROL 14-ALPHA-DEMETHYLASE)	1x8v	CYTOCHROME P450 51 (Mycobacterium tuberculosis)	5 / 12	TYR A 76 MET A 79 PHE A 83 ALA A 256 THR A 260	ESL A 471 ( 3.8A) ESL A 471 ( 4.4A) None ESL A 471 ( 3.4A) HEM A 470 (-3.6A)	1.24A	2x2nA-1x8vA: 37.7	2x2nA-1x8vA: 31.90
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.	2X2N_A_X2NA1480_1 (LANOSTEROL 14-ALPHA-DEMETHYLASE)	1x8v	CYTOCHROME P450 51 (Mycobacterium tuberculosis)	5 / 12	TYR A 76 PHE A 78 MET A 79 ALA A 256 MET A 325	ESL A 471 ( 3.8A) ESL A 471 ( 4.9A) ESL A 471 ( 4.4A) ESL A 471 ( 3.4A) None	1.08A	2x2nA-1x8vA: 37.7	2x2nA-1x8vA: 31.90
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.	2X2N_A_X2NA1480_1 (LANOSTEROL 14-ALPHA-DEMETHYLASE)	1x8v	CYTOCHROME P450 51 (Mycobacterium tuberculosis)	5 / 12	TYR A 76 PHE A 78 MET A 79 PHE A 83 ALA A 256	ESL A 471 ( 3.8A) ESL A 471 ( 4.9A) ESL A 471 ( 4.4A) None ESL A 471 ( 3.4A)	1.25A	2x2nA-1x8vA: 37.7	2x2nA-1x8vA: 31.90
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.	2X2N_B_X2NB1479_1 (LANOSTEROL 14-ALPHA-DEMETHYLASE)	1x8v	CYTOCHROME P450 51 (Mycobacterium tuberculosis)	6 / 12	MET A 79 PHE A 83 ALA A 256 THR A 260 LEU A 321 MET A 325	ESL A 471 ( 4.4A) None ESL A 471 ( 3.4A) HEM A 470 (-3.6A) HEM A 470 (-4.1A) None	1.07A	2x2nB-1x8vA: 38.1	2x2nB-1x8vA: 31.90
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.	2X2N_B_X2NB1479_1 (LANOSTEROL 14-ALPHA-DEMETHYLASE)	1x8v	CYTOCHROME P450 51 (Mycobacterium tuberculosis)	6 / 12	PHE A 78 MET A 79 PHE A 83 ALA A 256 LEU A 321 MET A 325	ESL A 471 ( 4.9A) ESL A 471 ( 4.4A) None ESL A 471 ( 3.4A) HEM A 470 (-4.1A) None	1.07A	2x2nB-1x8vA: 38.1	2x2nB-1x8vA: 31.90
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.	2X2N_C_X2NC1479_1 (LANOSTEROL 14-ALPHA-DEMETHYLASE)	1x8v	CYTOCHROME P450 51 (Mycobacterium tuberculosis)	6 / 12	MET A 79 PHE A 83 ALA A 256 THR A 260 LEU A 321 MET A 325	ESL A 471 ( 4.4A) None ESL A 471 ( 3.4A) HEM A 470 (-3.6A) HEM A 470 (-4.1A) None	1.13A	2x2nC-1x8vA: 38.5	2x2nC-1x8vA: 31.90
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.	2X2N_C_X2NC1479_1 (LANOSTEROL 14-ALPHA-DEMETHYLASE)	1x8v	CYTOCHROME P450 51 (Mycobacterium tuberculosis)	6 / 12	PHE A 78 MET A 79 PHE A 83 ALA A 256 LEU A 321 MET A 325	ESL A 471 ( 4.9A) ESL A 471 ( 4.4A) None ESL A 471 ( 3.4A) HEM A 470 (-4.1A) None	1.14A	2x2nC-1x8vA: 38.5	2x2nC-1x8vA: 31.90
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.	2X2N_D_X2ND1479_1 (LANOSTEROL 14-ALPHA-DEMETHYLASE)	1x8v	CYTOCHROME P450 51 (Mycobacterium tuberculosis)	7 / 12	TYR A 76 MET A 79 PHE A 83 ALA A 256 THR A 260 LEU A 321 MET A 325	ESL A 471 ( 3.8A) ESL A 471 ( 4.4A) None ESL A 471 ( 3.4A) HEM A 470 (-3.6A) HEM A 470 (-4.1A) None	1.19A	2x2nD-1x8vA: 37.9	2x2nD-1x8vA: 31.90
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.	2X2N_D_X2ND1479_1 (LANOSTEROL 14-ALPHA-DEMETHYLASE)	1x8v	CYTOCHROME P450 51 (Mycobacterium tuberculosis)	7 / 12	TYR A 76 PHE A 78 MET A 79 PHE A 83 ALA A 256 LEU A 321 MET A 325	ESL A 471 ( 3.8A) ESL A 471 ( 4.9A) ESL A 471 ( 4.4A) None ESL A 471 ( 3.4A) HEM A 470 (-4.1A) None	1.22A	2x2nD-1x8vA: 37.9	2x2nD-1x8vA: 31.90
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.	3E4E_A_4PZA501_1 (CYTOCHROME P450 2E1)	1x8v	CYTOCHROME P450 51 (Mycobacterium tuberculosis)	3 / 3	ALA A 256 THR A 260 CYH A 394	ESL A 471 ( 3.4A) HEM A 470 (-3.6A) HEM A 470 (-2.4A)	0.52A	3e4eA-1x8vA: 31.5	3e4eA-1x8vA: 23.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.	3E4E_B_4PZB501_1 (CYTOCHROME P450 2E1)	1x8v	CYTOCHROME P450 51 (Mycobacterium tuberculosis)	3 / 3	ALA A 256 THR A 260 CYH A 394	ESL A 471 ( 3.4A) HEM A 470 (-3.6A) HEM A 470 (-2.4A)	0.42A	3e4eB-1x8vA: 31.6	3e4eB-1x8vA: 23.43
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.	3KHM_A_TPFA501_1 (STEROL 14 ALPHA-DEMETHYLASE)	1x8v	CYTOCHROME P450 51 (Mycobacterium tuberculosis)	5 / 8	MET A 79 PHE A 83 ALA A 256 THR A 260 LEU A 321	ESL A 471 ( 4.4A) None ESL A 471 ( 3.4A) HEM A 470 (-3.6A) HEM A 470 (-4.1A)	0.97A	3khmA-1x8vA: 38.0	3khmA-1x8vA: 32.71
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.	3L4D_A_TPFA490_1 (STEROL 14-ALPHA DEMETHYLASE)	1x8v	CYTOCHROME P450 51 (Mycobacterium tuberculosis)	4 / 8	TYR A 76 ALA A 256 THR A 260 LEU A 321	ESL A 471 ( 3.8A) ESL A 471 ( 3.4A) HEM A 470 (-3.6A) HEM A 470 (-4.1A)	0.75A	3l4dA-1x8vA: 38.6	3l4dA-1x8vA: 32.63
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.	3L4D_B_TPFB490_1 (STEROL 14-ALPHA DEMETHYLASE)	1x8v	CYTOCHROME P450 51 (Mycobacterium tuberculosis)	5 / 9	MET A 79 PHE A 83 ALA A 256 THR A 260 LEU A 321	ESL A 471 ( 4.4A) None ESL A 471 ( 3.4A) HEM A 470 (-3.6A) HEM A 470 (-4.1A)	1.04A	3l4dB-1x8vA: 38.6	3l4dB-1x8vA: 32.63
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.	3L4D_C_TPFC490_1 (STEROL 14-ALPHA DEMETHYLASE)	1x8v	CYTOCHROME P450 51 (Mycobacterium tuberculosis)	5 / 9	MET A 79 PHE A 83 ALA A 256 THR A 260 LEU A 321	ESL A 471 ( 4.4A) None ESL A 471 ( 3.4A) HEM A 470 (-3.6A) HEM A 470 (-4.1A)	1.05A	3l4dC-1x8vA: 38.6	3l4dC-1x8vA: 32.63
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.	3L4D_D_TPFD490_1 (STEROL 14-ALPHA DEMETHYLASE)	1x8v	CYTOCHROME P450 51 (Mycobacterium tuberculosis)	5 / 8	MET A 79 PHE A 83 ALA A 256 THR A 260 LEU A 321	ESL A 471 ( 4.4A) None ESL A 471 ( 3.4A) HEM A 470 (-3.6A) HEM A 470 (-4.1A)	1.04A	3l4dD-1x8vA: 38.7	3l4dD-1x8vA: 32.63
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.	3LD6_A_KKKA602_1 (LANOSTEROL 14-ALPHA DEMETHYLASE)	1x8v	CYTOCHROME P450 51 (Mycobacterium tuberculosis)	5 / 12	PHE A 83 ALA A 256 THR A 260 ILE A 323 MET A 325	None ESL A 471 ( 3.4A) HEM A 470 (-3.6A) None None	0.99A	3ld6A-1x8vA: 41.5	3ld6A-1x8vA: 34.32
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.	3LD6_A_KKKA602_1 (LANOSTEROL 14-ALPHA DEMETHYLASE)	1x8v	CYTOCHROME P450 51 (Mycobacterium tuberculosis)	5 / 12	TYR A 76 PHE A 83 THR A 260 ILE A 323 MET A 325	ESL A 471 ( 3.8A) None HEM A 470 (-3.6A) None None	0.99A	3ld6A-1x8vA: 41.5	3ld6A-1x8vA: 34.32
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.	3NXU_B_RITB600_1 (CYTOCHROME P450 3A4)	1x8v	CYTOCHROME P450 51 (Mycobacterium tuberculosis)	5 / 12	MET A 433 PHE A 78 ILE A 323 ALA A 346 ALA A 389	ESL A 471 (-4.7A) ESL A 471 ( 4.9A) None None None	1.14A	3nxuB-1x8vA: 34.5	3nxuB-1x8vA: 25.39
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.	3T3S_C_9PLC1_1 (CYTOCHROME P450 2A13)	1x8v	CYTOCHROME P450 51 (Mycobacterium tuberculosis)	4 / 7	PHE A 255 ALA A 256 THR A 260 LEU A 321	None ESL A 471 ( 3.4A) HEM A 470 (-3.6A) HEM A 470 (-4.1A)	0.61A	3t3sC-1x8vA: 31.8	3t3sC-1x8vA: 25.51
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.	4ZE0_A_VORA602_1 (LANOSTEROL 14-ALPHA DEMETHYLASE)	1x8v	CYTOCHROME P450 51 (Mycobacterium tuberculosis)	5 / 9	TYR A 76 PHE A 83 THR A 260 LEU A 321 LEU A 324	ESL A 471 ( 3.8A) None HEM A 470 (-3.6A) HEM A 470 (-4.1A) HEM A 470 ( 3.9A)	0.88A	4ze0A-1x8vA: 34.4	4ze0A-1x8vA: 28.78
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.	4ZE3_A_TPFA602_1 (LANOSTEROL 14-ALPHA DEMETHYLASE)	1x8v	CYTOCHROME P450 51 (Mycobacterium tuberculosis)	4 / 7	TYR A 76 PHE A 83 THR A 260 LEU A 321	ESL A 471 ( 3.8A) None HEM A 470 (-3.6A) HEM A 470 (-4.1A)	0.93A	4ze3A-1x8vA: 35.3	4ze3A-1x8vA: 28.60
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.	5ESE_A_TPFA602_1 (LANOSTEROL 14-ALPHA DEMETHYLASE)	1x8v	CYTOCHROME P450 51 (Mycobacterium tuberculosis)	4 / 8	TYR A 76 PHE A 83 THR A 260 LEU A 321	ESL A 471 ( 3.8A) None HEM A 470 (-3.6A) HEM A 470 (-4.1A)	0.90A	5eseA-1x8vA: 35.6	5eseA-1x8vA: 28.60
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.	5ESF_A_TPFA602_1 (LANOSTEROL 14-ALPHA DEMETHYLASE)	1x8v	CYTOCHROME P450 51 (Mycobacterium tuberculosis)	4 / 8	TYR A 76 PHE A 83 THR A 260 LEU A 321	ESL A 471 ( 3.8A) None HEM A 470 (-3.6A) HEM A 470 (-4.1A)	0.90A	5esfA-1x8vA: 35.3	5esfA-1x8vA: 28.83
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.	5ESH_A_1YNA602_1 (LANOSTEROL 14-ALPHA DEMETHYLASE)	1x8v	CYTOCHROME P450 51 (Mycobacterium tuberculosis)	5 / 12	LEU A 19 TYR A 76 PHE A 83 THR A 260 LEU A 321	None ESL A 471 ( 3.8A) None HEM A 470 (-3.6A) HEM A 470 (-4.1A)	1.04A	5eshA-1x8vA: 34.7	5eshA-1x8vA: 28.60
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.	5ESM_A_TPFA602_1 (LANOSTEROL 14-ALPHA DEMETHYLASE)	1x8v	CYTOCHROME P450 51 (Mycobacterium tuberculosis)	4 / 7	TYR A 76 PHE A 83 THR A 260 LEU A 321	ESL A 471 ( 3.8A) None HEM A 470 (-3.6A) HEM A 470 (-4.1A)	0.90A	5esmA-1x8vA: 35.2	5esmA-1x8vA: 28.42
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.	5HS1_A_VORA602_1 (LANOSTEROL 14-ALPHA DEMETHYLASE)	1x8v	CYTOCHROME P450 51 (Mycobacterium tuberculosis)	5 / 8	TYR A 76 PHE A 83 THR A 260 LEU A 321 LEU A 324	ESL A 471 ( 3.8A) None HEM A 470 (-3.6A) HEM A 470 (-4.1A) HEM A 470 ( 3.9A)	0.91A	5hs1A-1x8vA: 35.5	5hs1A-1x8vA: 27.71
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.	6AY4_A_TPFA506_1 (CYP51, STEROL 14ALPHA-DEMETHYLASE)	1x8v	CYTOCHROME P450 51 (Mycobacterium tuberculosis)	7 / 10	MET A 79 PHE A 83 PHE A 255 ALA A 256 THR A 260 LEU A 321 CYH A 394	ESL A 471 ( 4.4A) None None ESL A 471 ( 3.4A) HEM A 470 (-3.6A) HEM A 470 (-4.1A) HEM A 470 (-2.4A)	1.03A	6ay4A-1x8vA: 41.4	6ay4A-1x8vA: 32.43
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.	6AY4_A_TPFA506_1 (CYP51, STEROL 14ALPHA-DEMETHYLASE)	1x8v	CYTOCHROME P450 51 (Mycobacterium tuberculosis)	7 / 10	TYR A 76 MET A 79 PHE A 83 PHE A 255 THR A 260 LEU A 321 CYH A 394	ESL A 471 ( 3.8A) ESL A 471 ( 4.4A) None None HEM A 470 (-3.6A) HEM A 470 (-4.1A) HEM A 470 (-2.4A)	0.90A	6ay4A-1x8vA: 41.4	6ay4A-1x8vA: 32.43
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.	6AY4_A_TPFA506_1 (CYP51, STEROL 14ALPHA-DEMETHYLASE)	1x8v	CYTOCHROME P450 51 (Mycobacterium tuberculosis)	5 / 10	TYR A 76 PHE A 255 ALA A 256 THR A 260 CYH A 394	ESL A 471 ( 3.8A) None ESL A 471 ( 3.4A) HEM A 470 (-3.6A) HEM A 470 (-2.4A)	1.15A	6ay4A-1x8vA: 41.4	6ay4A-1x8vA: 32.43
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.	6AY6_A_VORA501_1 (CYP51, STEROL 14ALPHA-DEMETHYLASE)	1x8v	CYTOCHROME P450 51 (Mycobacterium tuberculosis)	6 / 9	TYR A 76 PHE A 83 ALA A 256 THR A 260 LEU A 321 CYH A 394	ESL A 471 ( 3.8A) None ESL A 471 ( 3.4A) HEM A 470 (-3.6A) HEM A 470 (-4.1A) HEM A 470 (-2.4A)	0.94A	6ay6A-1x8vA: 41.4	6ay6A-1x8vA: 32.43
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.	6AYB_A_KKKA508_1 (CYP51, STEROL 14ALPHA-DEMETHYLASE)	1x8v	CYTOCHROME P450 51 (Mycobacterium tuberculosis)	5 / 12	TYR A 76 PHE A 78 LEU A 321 ILE A 322 MET A 325	ESL A 471 ( 3.8A) ESL A 471 ( 4.9A) HEM A 470 (-4.1A) None None	1.15A	6aybA-1x8vA: 41.6	6aybA-1x8vA: 32.43
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.	6AYB_A_KKKA508_1 (CYP51, STEROL 14ALPHA-DEMETHYLASE)	1x8v	CYTOCHROME P450 51 (Mycobacterium tuberculosis)	5 / 12	TYR A 76 THR A 260 LEU A 321 ILE A 322 MET A 325	ESL A 471 ( 3.8A) HEM A 470 (-3.6A) HEM A 470 (-4.1A) None None	0.88A	6aybA-1x8vA: 41.6	6aybA-1x8vA: 32.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.	6AYC_A_1YNA502_1 (PROTEIN CYP51)	1x8v	CYTOCHROME P450 51 (Mycobacterium tuberculosis)	6 / 12	TYR A 76 MET A 79 ALA A 256 THR A 260 LEU A 321 MET A 325	ESL A 471 ( 3.8A) ESL A 471 ( 4.4A) ESL A 471 ( 3.4A) HEM A 470 (-3.6A) HEM A 470 (-4.1A) None	0.97A	6aycA-1x8vA: 42.0	6aycA-1x8vA: 9.09
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.	6AYC_A_1YNA502_1 (PROTEIN CYP51)	1x8v	CYTOCHROME P450 51 (Mycobacterium tuberculosis)	5 / 12	TYR A 76 MET A 79 PHE A 83 ALA A 256 THR A 260	ESL A 471 ( 3.8A) ESL A 471 ( 4.4A) None ESL A 471 ( 3.4A) HEM A 470 (-3.6A)	0.94A	6aycA-1x8vA: 42.0	6aycA-1x8vA: 9.09
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.	6AYC_A_1YNA502_1 (PROTEIN CYP51)	1x8v	CYTOCHROME P450 51 (Mycobacterium tuberculosis)	5 / 12	TYR A 76 PHE A 78 MET A 79 LEU A 321 MET A 325	ESL A 471 ( 3.8A) ESL A 471 ( 4.9A) ESL A 471 ( 4.4A) HEM A 470 (-4.1A) None	1.07A	6aycA-1x8vA: 42.0	6aycA-1x8vA: 9.09

[["DrReposER ID","Desc.","Hit PDB","Hit molecule","Hit organism","Res. no.","Interface","HETATM","RMSD","Z-score","Seq ID"],["1EA1_A_TPFA470_1","CYTOCHROME P450 51-LIKE RV0764C","1x8v","CYTOCHROME P450 51","Mycobacterium tuberculosis",4,"PHE A  78;MET A  79;ARG A  96;PHE A 255","ESL A 471 ( 4.9A);ESL A 471 ( 4.4A);ESL A 471 (-3.6A);None","0.80A","1ea1A-1x8vA:61.2",null],["1EA1_A_TPFA470_1","CYTOCHROME P450 51-LIKE RV0764C","1x8v","CYTOCHROME P450 51","Mycobacterium tuberculosis",6,"TYR A  76;PHE A  78;MET A  79;PHE A 255;THR A 260;LEU A 321","ESL A 471 ( 3.8A);ESL A 471 ( 4.9A);ESL A 471 ( 4.4A);None;HEM A 470 (-3.6A);HEM A 470 (-4.1A)","0.52A","1ea1A-1x8vA:61.2","1ea1A-1x8vA:99.56"],["2WUZ_A_TPFA1460_1","LANOSTEROL 14-ALPHA-DEMETHYLASE, PUTATIVE","1x8v","CYTOCHROME P450 51","Mycobacterium tuberculosis",5,"MET A  79;PHE A  83;ALA A 256;THR A 260;LEU A 321","ESL A 471 ( 4.4A);None;ESL A 471 ( 3.4A);HEM A 470 (-3.6A);HEM A 470 (-4.1A)","1.06A","2wuzA-1x8vA:39.7","1ea1A-1x8vA:99.56"],["2WUZ_B_TPFB1460_1","LANOSTEROL 14-ALPHA-DEMETHYLASE, PUTATIVE","1x8v","CYTOCHROME P450 51","Mycobacterium tuberculosis",5,"MET A  79;PHE A  83;ALA A 256;THR A 260;LEU A 321","ESL A 471 ( 4.4A);None;ESL A 471 ( 3.4A);HEM A 470 (-3.6A);HEM A 470 (-4.1A)","1.07A","2wuzB-1x8vA:39.6","2wuzA-1x8vA:32.11"],["2WX2_A_TPFA1460_1","LANOSTEROL 14-ALPHA-DEMETHYLASE","1x8v","CYTOCHROME P450 51","Mycobacterium tuberculosis",5,"MET A  79;PHE A  83;ALA A 256;THR A 260;LEU A 321","ESL A 471 ( 4.4A);None;ESL A 471 ( 3.4A);HEM A 470 (-3.6A);HEM A 470 (-4.1A)","0.95A","2wx2A-1x8vA:37.9","2wuzB-1x8vA:32.11"],["2X2N_A_X2NA1480_1","LANOSTEROL 14-ALPHA-DEMETHYLASE","1x8v","CYTOCHROME P450 51","Mycobacterium tuberculosis",5,"TYR A  76;MET A  79;ALA A 256;THR A 260;MET A 325","ESL A 471 ( 3.8A);ESL A 471 ( 4.4A);ESL A 471 ( 3.4A);HEM A 470 (-3.6A);None","1.04A","2x2nA-1x8vA:37.7","2wx2A-1x8vA:32.11"],["2X2N_A_X2NA1480_1","LANOSTEROL 14-ALPHA-DEMETHYLASE","1x8v","CYTOCHROME P450 51","Mycobacterium tuberculosis",5,"TYR A  76;MET A  79;PHE A  83;ALA A 256;THR A 260","ESL A 471 ( 3.8A);ESL A 471 ( 4.4A);None;ESL A 471 ( 3.4A);HEM A 470 (-3.6A)","1.24A","2x2nA-1x8vA:37.7","2x2nA-1x8vA:31.90"],["2X2N_A_X2NA1480_1","LANOSTEROL 14-ALPHA-DEMETHYLASE","1x8v","CYTOCHROME P450 51","Mycobacterium tuberculosis",5,"TYR A  76;PHE A  78;MET A  79;ALA A 256;MET A 325","ESL A 471 ( 3.8A);ESL A 471 ( 4.9A);ESL A 471 ( 4.4A);ESL A 471 ( 3.4A);None","1.08A","2x2nA-1x8vA:37.7","2x2nA-1x8vA:31.90"],["2X2N_A_X2NA1480_1","LANOSTEROL 14-ALPHA-DEMETHYLASE","1x8v","CYTOCHROME P450 51","Mycobacterium tuberculosis",5,"TYR A  76;PHE A  78;MET A  79;PHE A  83;ALA A 256","ESL A 471 ( 3.8A);ESL A 471 ( 4.9A);ESL A 471 ( 4.4A);None;ESL A 471 ( 3.4A)","1.25A","2x2nA-1x8vA:37.7","2x2nA-1x8vA:31.90"],["2X2N_B_X2NB1479_1","LANOSTEROL 14-ALPHA-DEMETHYLASE","1x8v","CYTOCHROME P450 51","Mycobacterium tuberculosis",6,"MET A  79;PHE A  83;ALA A 256;THR A 260;LEU A 321;MET A 325","ESL A 471 ( 4.4A);None;ESL A 471 ( 3.4A);HEM A 470 (-3.6A);HEM A 470 (-4.1A);None","1.07A","2x2nB-1x8vA:38.1","2x2nA-1x8vA:31.90"],["2X2N_B_X2NB1479_1","LANOSTEROL 14-ALPHA-DEMETHYLASE","1x8v","CYTOCHROME P450 51","Mycobacterium tuberculosis",6,"PHE A  78;MET A  79;PHE A  83;ALA A 256;LEU A 321;MET A 325","ESL A 471 ( 4.9A);ESL A 471 ( 4.4A);None;ESL A 471 ( 3.4A);HEM A 470 (-4.1A);None","1.07A","2x2nB-1x8vA:38.1","2x2nB-1x8vA:31.90"],["2X2N_C_X2NC1479_1","LANOSTEROL 14-ALPHA-DEMETHYLASE","1x8v","CYTOCHROME P450 51","Mycobacterium tuberculosis",6,"MET A  79;PHE A  83;ALA A 256;THR A 260;LEU A 321;MET A 325","ESL A 471 ( 4.4A);None;ESL A 471 ( 3.4A);HEM A 470 (-3.6A);HEM A 470 (-4.1A);None","1.13A","2x2nC-1x8vA:38.5","2x2nB-1x8vA:31.90"],["2X2N_C_X2NC1479_1","LANOSTEROL 14-ALPHA-DEMETHYLASE","1x8v","CYTOCHROME P450 51","Mycobacterium tuberculosis",6,"PHE A  78;MET A  79;PHE A  83;ALA A 256;LEU A 321;MET A 325","ESL A 471 ( 4.9A);ESL A 471 ( 4.4A);None;ESL A 471 ( 3.4A);HEM A 470 (-4.1A);None","1.14A","2x2nC-1x8vA:38.5","2x2nC-1x8vA:31.90"],["2X2N_D_X2ND1479_1","LANOSTEROL 14-ALPHA-DEMETHYLASE","1x8v","CYTOCHROME P450 51","Mycobacterium tuberculosis",7,"TYR A  76;MET A  79;PHE A  83;ALA A 256;THR A 260;LEU A 321;MET A 325","ESL A 471 ( 3.8A);ESL A 471 ( 4.4A);None;ESL A 471 ( 3.4A);HEM A 470 (-3.6A);HEM A 470 (-4.1A);None","1.19A","2x2nD-1x8vA:37.9","2x2nC-1x8vA:31.90"],["2X2N_D_X2ND1479_1","LANOSTEROL 14-ALPHA-DEMETHYLASE","1x8v","CYTOCHROME P450 51","Mycobacterium tuberculosis",7,"TYR A  76;PHE A  78;MET A  79;PHE A  83;ALA A 256;LEU A 321;MET A 325","ESL A 471 ( 3.8A);ESL A 471 ( 4.9A);ESL A 471 ( 4.4A);None;ESL A 471 ( 3.4A);HEM A 470 (-4.1A);None","1.22A","2x2nD-1x8vA:37.9","2x2nD-1x8vA:31.90"],["3E4E_A_4PZA501_1","CYTOCHROME P450 2E1","1x8v","CYTOCHROME P450 51","Mycobacterium tuberculosis",3,"ALA A 256;THR A 260;CYH A 394","ESL A 471 ( 3.4A);HEM A 470 (-3.6A);HEM A 470 (-2.4A)","0.52A","3e4eA-1x8vA:31.5","2x2nD-1x8vA:31.90"],["3E4E_B_4PZB501_1","CYTOCHROME P450 2E1","1x8v","CYTOCHROME P450 51","Mycobacterium tuberculosis",3,"ALA A 256;THR A 260;CYH A 394","ESL A 471 ( 3.4A);HEM A 470 (-3.6A);HEM A 470 (-2.4A)","0.42A","3e4eB-1x8vA:31.6","3e4eA-1x8vA:23.43"],["3KHM_A_TPFA501_1","STEROL 14 ALPHA-DEMETHYLASE","1x8v","CYTOCHROME P450 51","Mycobacterium tuberculosis",5,"MET A  79;PHE A  83;ALA A 256;THR A 260;LEU A 321","ESL A 471 ( 4.4A);None;ESL A 471 ( 3.4A);HEM A 470 (-3.6A);HEM A 470 (-4.1A)","0.97A","3khmA-1x8vA:38.0","3e4eB-1x8vA:23.43"],["3L4D_A_TPFA490_1","STEROL 14-ALPHA DEMETHYLASE","1x8v","CYTOCHROME P450 51","Mycobacterium tuberculosis",4,"TYR A  76;ALA A 256;THR A 260;LEU A 321","ESL A 471 ( 3.8A);ESL A 471 ( 3.4A);HEM A 470 (-3.6A);HEM A 470 (-4.1A)","0.75A","3l4dA-1x8vA:38.6","3khmA-1x8vA:32.71"],["3L4D_B_TPFB490_1","STEROL 14-ALPHA DEMETHYLASE","1x8v","CYTOCHROME P450 51","Mycobacterium tuberculosis",5,"MET A  79;PHE A  83;ALA A 256;THR A 260;LEU A 321","ESL A 471 ( 4.4A);None;ESL A 471 ( 3.4A);HEM A 470 (-3.6A);HEM A 470 (-4.1A)","1.04A","3l4dB-1x8vA:38.6","3l4dA-1x8vA:32.63"],["3L4D_C_TPFC490_1","STEROL 14-ALPHA DEMETHYLASE","1x8v","CYTOCHROME P450 51","Mycobacterium tuberculosis",5,"MET A  79;PHE A  83;ALA A 256;THR A 260;LEU A 321","ESL A 471 ( 4.4A);None;ESL A 471 ( 3.4A);HEM A 470 (-3.6A);HEM A 470 (-4.1A)","1.05A","3l4dC-1x8vA:38.6","3l4dB-1x8vA:32.63"],["3L4D_D_TPFD490_1","STEROL 14-ALPHA DEMETHYLASE","1x8v","CYTOCHROME P450 51","Mycobacterium tuberculosis",5,"MET A  79;PHE A  83;ALA A 256;THR A 260;LEU A 321","ESL A 471 ( 4.4A);None;ESL A 471 ( 3.4A);HEM A 470 (-3.6A);HEM A 470 (-4.1A)","1.04A","3l4dD-1x8vA:38.7","3l4dC-1x8vA:32.63"],["3LD6_A_KKKA602_1","LANOSTEROL 14-ALPHA DEMETHYLASE","1x8v","CYTOCHROME P450 51","Mycobacterium tuberculosis",5,"PHE A  83;ALA A 256;THR A 260;ILE A 323;MET A 325","None;ESL A 471 ( 3.4A);HEM A 470 (-3.6A);None;None","0.99A","3ld6A-1x8vA:41.5","3l4dD-1x8vA:32.63"],["3LD6_A_KKKA602_1","LANOSTEROL 14-ALPHA DEMETHYLASE","1x8v","CYTOCHROME P450 51","Mycobacterium tuberculosis",5,"TYR A  76;PHE A  83;THR A 260;ILE A 323;MET A 325","ESL A 471 ( 3.8A);None;HEM A 470 (-3.6A);None;None","0.99A","3ld6A-1x8vA:41.5","3ld6A-1x8vA:34.32"],["3NXU_B_RITB600_1","CYTOCHROME P450 3A4","1x8v","CYTOCHROME P450 51","Mycobacterium tuberculosis",5,"MET A 433;PHE A  78;ILE A 323;ALA A 346;ALA A 389","ESL A 471 (-4.7A);ESL A 471 ( 4.9A);None;None;None","1.14A","3nxuB-1x8vA:34.5","3ld6A-1x8vA:34.32"],["3T3S_C_9PLC1_1","CYTOCHROME P450 2A13","1x8v","CYTOCHROME P450 51","Mycobacterium tuberculosis",4,"PHE A 255;ALA A 256;THR A 260;LEU A 321","None;ESL A 471 ( 3.4A);HEM A 470 (-3.6A);HEM A 470 (-4.1A)","0.61A","3t3sC-1x8vA:31.8","3nxuB-1x8vA:25.39"],["4ZE0_A_VORA602_1","LANOSTEROL 14-ALPHA DEMETHYLASE","1x8v","CYTOCHROME P450 51","Mycobacterium tuberculosis",5,"TYR A  76;PHE A  83;THR A 260;LEU A 321;LEU A 324","ESL A 471 ( 3.8A);None;HEM A 470 (-3.6A);HEM A 470 (-4.1A);HEM A 470 ( 3.9A)","0.88A","4ze0A-1x8vA:34.4","3t3sC-1x8vA:25.51"],["4ZE3_A_TPFA602_1","LANOSTEROL 14-ALPHA DEMETHYLASE","1x8v","CYTOCHROME P450 51","Mycobacterium tuberculosis",4,"TYR A  76;PHE A  83;THR A 260;LEU A 321","ESL A 471 ( 3.8A);None;HEM A 470 (-3.6A);HEM A 470 (-4.1A)","0.93A","4ze3A-1x8vA:35.3","4ze0A-1x8vA:28.78"],["5ESE_A_TPFA602_1","LANOSTEROL 14-ALPHA DEMETHYLASE","1x8v","CYTOCHROME P450 51","Mycobacterium tuberculosis",4,"TYR A  76;PHE A  83;THR A 260;LEU A 321","ESL A 471 ( 3.8A);None;HEM A 470 (-3.6A);HEM A 470 (-4.1A)","0.90A","5eseA-1x8vA:35.6","4ze3A-1x8vA:28.60"],["5ESF_A_TPFA602_1","LANOSTEROL 14-ALPHA DEMETHYLASE","1x8v","CYTOCHROME P450 51","Mycobacterium tuberculosis",4,"TYR A  76;PHE A  83;THR A 260;LEU A 321","ESL A 471 ( 3.8A);None;HEM A 470 (-3.6A);HEM A 470 (-4.1A)","0.90A","5esfA-1x8vA:35.3","5eseA-1x8vA:28.60"],["5ESH_A_1YNA602_1","LANOSTEROL 14-ALPHA DEMETHYLASE","1x8v","CYTOCHROME P450 51","Mycobacterium tuberculosis",5,"LEU A  19;TYR A  76;PHE A  83;THR A 260;LEU A 321","None;ESL A 471 ( 3.8A);None;HEM A 470 (-3.6A);HEM A 470 (-4.1A)","1.04A","5eshA-1x8vA:34.7","5esfA-1x8vA:28.83"],["5ESM_A_TPFA602_1","LANOSTEROL 14-ALPHA DEMETHYLASE","1x8v","CYTOCHROME P450 51","Mycobacterium tuberculosis",4,"TYR A  76;PHE A  83;THR A 260;LEU A 321","ESL A 471 ( 3.8A);None;HEM A 470 (-3.6A);HEM A 470 (-4.1A)","0.90A","5esmA-1x8vA:35.2","5eshA-1x8vA:28.60"],["5HS1_A_VORA602_1","LANOSTEROL 14-ALPHA DEMETHYLASE","1x8v","CYTOCHROME P450 51","Mycobacterium tuberculosis",5,"TYR A  76;PHE A  83;THR A 260;LEU A 321;LEU A 324","ESL A 471 ( 3.8A);None;HEM A 470 (-3.6A);HEM A 470 (-4.1A);HEM A 470 ( 3.9A)","0.91A","5hs1A-1x8vA:35.5","5esmA-1x8vA:28.42"],["6AY4_A_TPFA506_1","CYP51, STEROL 14ALPHA-DEMETHYLASE","1x8v","CYTOCHROME P450 51","Mycobacterium tuberculosis",7,"MET A  79;PHE A  83;PHE A 255;ALA A 256;THR A 260;LEU A 321;CYH A 394","ESL A 471 ( 4.4A);None;None;ESL A 471 ( 3.4A);HEM A 470 (-3.6A);HEM A 470 (-4.1A);HEM A 470 (-2.4A)","1.03A","6ay4A-1x8vA:41.4","5hs1A-1x8vA:27.71"],["6AY4_A_TPFA506_1","CYP51, STEROL 14ALPHA-DEMETHYLASE","1x8v","CYTOCHROME P450 51","Mycobacterium tuberculosis",7,"TYR A  76;MET A  79;PHE A  83;PHE A 255;THR A 260;LEU A 321;CYH A 394","ESL A 471 ( 3.8A);ESL A 471 ( 4.4A);None;None;HEM A 470 (-3.6A);HEM A 470 (-4.1A);HEM A 470 (-2.4A)","0.90A","6ay4A-1x8vA:41.4","6ay4A-1x8vA:32.43"],["6AY4_A_TPFA506_1","CYP51, STEROL 14ALPHA-DEMETHYLASE","1x8v","CYTOCHROME P450 51","Mycobacterium tuberculosis",5,"TYR A  76;PHE A 255;ALA A 256;THR A 260;CYH A 394","ESL A 471 ( 3.8A);None;ESL A 471 ( 3.4A);HEM A 470 (-3.6A);HEM A 470 (-2.4A)","1.15A","6ay4A-1x8vA:41.4","6ay4A-1x8vA:32.43"],["6AY6_A_VORA501_1","CYP51, STEROL 14ALPHA-DEMETHYLASE","1x8v","CYTOCHROME P450 51","Mycobacterium tuberculosis",6,"TYR A  76;PHE A  83;ALA A 256;THR A 260;LEU A 321;CYH A 394","ESL A 471 ( 3.8A);None;ESL A 471 ( 3.4A);HEM A 470 (-3.6A);HEM A 470 (-4.1A);HEM A 470 (-2.4A)","0.94A","6ay6A-1x8vA:41.4","6ay4A-1x8vA:32.43"],["6AYB_A_KKKA508_1","CYP51, STEROL 14ALPHA-DEMETHYLASE","1x8v","CYTOCHROME P450 51","Mycobacterium tuberculosis",5,"TYR A  76;PHE A  78;LEU A 321;ILE A 322;MET A 325","ESL A 471 ( 3.8A);ESL A 471 ( 4.9A);HEM A 470 (-4.1A);None;None","1.15A","6aybA-1x8vA:41.6","6ay6A-1x8vA:32.43"],["6AYB_A_KKKA508_1","CYP51, STEROL 14ALPHA-DEMETHYLASE","1x8v","CYTOCHROME P450 51","Mycobacterium tuberculosis",5,"TYR A  76;THR A 260;LEU A 321;ILE A 322;MET A 325","ESL A 471 ( 3.8A);HEM A 470 (-3.6A);HEM A 470 (-4.1A);None;None","0.88A","6aybA-1x8vA:41.6","6aybA-1x8vA:32.43"],["6AYC_A_1YNA502_1","PROTEIN CYP51","1x8v","CYTOCHROME P450 51","Mycobacterium tuberculosis",6,"TYR A  76;MET A  79;ALA A 256;THR A 260;LEU A 321;MET A 325","ESL A 471 ( 3.8A);ESL A 471 ( 4.4A);ESL A 471 ( 3.4A);HEM A 470 (-3.6A);HEM A 470 (-4.1A);None","0.97A","6aycA-1x8vA:42.0","6aybA-1x8vA:32.43"],["6AYC_A_1YNA502_1","PROTEIN CYP51","1x8v","CYTOCHROME P450 51","Mycobacterium tuberculosis",5,"TYR A  76;MET A  79;PHE A  83;ALA A 256;THR A 260","ESL A 471 ( 3.8A);ESL A 471 ( 4.4A);None;ESL A 471 ( 3.4A);HEM A 470 (-3.6A)","0.94A","6aycA-1x8vA:42.0","6aycA-1x8vA:9.09"],["6AYC_A_1YNA502_1","PROTEIN CYP51","1x8v","CYTOCHROME P450 51","Mycobacterium tuberculosis",5,"TYR A  76;PHE A  78;MET A  79;LEU A 321;MET A 325","ESL A 471 ( 3.8A);ESL A 471 ( 4.9A);ESL A 471 ( 4.4A);HEM A 470 (-4.1A);None","1.07A","6aycA-1x8vA:42.0","6aycA-1x8vA:9.09"]]