SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2riu'

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.	1V54_C_CHDC3271_0 (CYTOCHROME C OXIDASE POLYPEPTIDE III CYTOCHROME C OXIDASE POLYPEPTIDE VIIA-HEART)	2riu	3,4-DIHYDROXY-2-BUTA NONE 4-PHOSPHATE SYNTHASE (Candida albicans)	4 / 8	LEU A 113 PHE A 93 PHE A 123 LEU A 70	None	0.90A	1v54C-2riuA: undetectable 1v54J-2riuA: undetectable	1v54C-2riuA: 21.66 1v54J-2riuA: 14.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.	1XF1_A_ACTA1107_0 (C5A PEPTIDASE)	2riu	3,4-DIHYDROXY-2-BUTA NONE 4-PHOSPHATE SYNTHASE (Candida albicans)	4 / 5	GLY A 100 HIS A 128 ILE A 129 PHE A 93	None	0.80A	1xf1A-2riuA: undetectable	1xf1A-2riuA: 12.44
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.	1XF1_B_ACTB1108_0 (C5A PEPTIDASE)	2riu	3,4-DIHYDROXY-2-BUTA NONE 4-PHOSPHATE SYNTHASE (Candida albicans)	4 / 6	GLY A 100 HIS A 128 ILE A 129 PHE A 93	None	0.80A	1xf1B-2riuA: undetectable	1xf1B-2riuA: 12.44
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.	2EIK_C_CHDC271_0 (CYTOCHROME C OXIDASE POLYPEPTIDE VIIA-HEART CYTOCHROME C OXIDASE SUBUNIT 3)	2riu	3,4-DIHYDROXY-2-BUTA NONE 4-PHOSPHATE SYNTHASE (Candida albicans)	4 / 7	LEU A 113 PHE A 93 PHE A 123 LEU A 70	None	0.92A	2eikC-2riuA: undetectable 2eikJ-2riuA: undetectable	2eikC-2riuA: 21.66 2eikJ-2riuA: 14.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.	2EIL_P_CHDP1271_0 (CYTOCHROME C OXIDASE POLYPEPTIDE VIIA-HEART CYTOCHROME C OXIDASE SUBUNIT 3)	2riu	3,4-DIHYDROXY-2-BUTA NONE 4-PHOSPHATE SYNTHASE (Candida albicans)	4 / 8	LEU A 113 PHE A 93 PHE A 123 LEU A 70	None	0.96A	2eilP-2riuA: undetectable 2eilW-2riuA: undetectable	2eilP-2riuA: 21.66 2eilW-2riuA: 14.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.	2EIM_W_CHDW1271_0 (CYTOCHROME C OXIDASE POLYPEPTIDE VIIA-HEART CYTOCHROME C OXIDASE SUBUNIT 3)	2riu	3,4-DIHYDROXY-2-BUTA NONE 4-PHOSPHATE SYNTHASE (Candida albicans)	4 / 7	LEU A 113 PHE A 93 PHE A 123 LEU A 70	None	0.94A	2eimP-2riuA: undetectable 2eimW-2riuA: undetectable	2eimP-2riuA: 21.66 2eimW-2riuA: 14.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.	3ABK_P_CHDP1271_0 (CYTOCHROME C OXIDASE POLYPEPTIDE 7A1 CYTOCHROME C OXIDASE SUBUNIT 3)	2riu	3,4-DIHYDROXY-2-BUTA NONE 4-PHOSPHATE SYNTHASE (Candida albicans)	4 / 6	LEU A 113 PHE A 93 PHE A 123 LEU A 70	None	0.97A	3abkP-2riuA: undetectable 3abkW-2riuA: undetectable	3abkP-2riuA: 21.66 3abkW-2riuA: 14.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.	3AG2_C_CHDC271_0 (CYTOCHROME C OXIDASE SUBUNIT 3)	2riu	3,4-DIHYDROXY-2-BUTA NONE 4-PHOSPHATE SYNTHASE (Candida albicans)	4 / 7	LEU A 113 PHE A 93 PHE A 123 LEU A 70	None	0.91A	3ag2C-2riuA: undetectable	3ag2C-2riuA: 21.66
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.	3AG2_P_CHDP1271_0 (CYTOCHROME C OXIDASE POLYPEPTIDE 7A1 CYTOCHROME C OXIDASE SUBUNIT 3)	2riu	3,4-DIHYDROXY-2-BUTA NONE 4-PHOSPHATE SYNTHASE (Candida albicans)	4 / 7	LEU A 113 PHE A 93 PHE A 123 LEU A 70	None	0.93A	3ag2P-2riuA: undetectable 3ag2W-2riuA: undetectable	3ag2P-2riuA: 21.66 3ag2W-2riuA: 14.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.	3AG4_C_CHDC271_0 (CYTOCHROME C OXIDASE POLYPEPTIDE 7A1 CYTOCHROME C OXIDASE SUBUNIT 3)	2riu	3,4-DIHYDROXY-2-BUTA NONE 4-PHOSPHATE SYNTHASE (Candida albicans)	4 / 8	LEU A 113 PHE A 93 PHE A 123 LEU A 70	None	0.93A	3ag4C-2riuA: undetectable 3ag4J-2riuA: undetectable	3ag4C-2riuA: 21.66 3ag4J-2riuA: 14.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.	3AG4_P_CHDP1271_0 (CYTOCHROME C OXIDASE POLYPEPTIDE 7A1 CYTOCHROME C OXIDASE SUBUNIT 3)	2riu	3,4-DIHYDROXY-2-BUTA NONE 4-PHOSPHATE SYNTHASE (Candida albicans)	4 / 7	LEU A 113 PHE A 93 PHE A 123 LEU A 70	None	0.93A	3ag4P-2riuA: undetectable 3ag4W-2riuA: undetectable	3ag4P-2riuA: 21.66 3ag4W-2riuA: 14.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.	3ASN_C_CHDC271_0 (CYTOCHROME C OXIDASE SUBUNIT 3 CYTOCHROME C OXIDASE SUBUNIT 7A1)	2riu	3,4-DIHYDROXY-2-BUTA NONE 4-PHOSPHATE SYNTHASE (Candida albicans)	4 / 7	LEU A 113 PHE A 93 PHE A 123 LEU A 70	None	0.90A	3asnC-2riuA: undetectable 3asnJ-2riuA: undetectable	3asnC-2riuA: 21.66 3asnJ-2riuA: 14.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.	3ASN_P_CHDP1271_0 (CYTOCHROME C OXIDASE SUBUNIT 3 CYTOCHROME C OXIDASE SUBUNIT 7A1)	2riu	3,4-DIHYDROXY-2-BUTA NONE 4-PHOSPHATE SYNTHASE (Candida albicans)	4 / 7	LEU A 113 PHE A 93 PHE A 123 LEU A 70	None	0.95A	3asnP-2riuA: undetectable 3asnW-2riuA: undetectable	3asnP-2riuA: 21.66 3asnW-2riuA: 14.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.	3ASO_C_CHDC271_0 (CYTOCHROME C OXIDASE SUBUNIT 3 CYTOCHROME C OXIDASE SUBUNIT 7A1)	2riu	3,4-DIHYDROXY-2-BUTA NONE 4-PHOSPHATE SYNTHASE (Candida albicans)	4 / 8	LEU A 113 PHE A 93 PHE A 123 LEU A 70	None	0.92A	3asoC-2riuA: undetectable 3asoJ-2riuA: undetectable	3asoC-2riuA: 21.66 3asoJ-2riuA: 14.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.	3ASO_P_CHDP1271_0 (CYTOCHROME C OXIDASE SUBUNIT 3 CYTOCHROME C OXIDASE SUBUNIT 7A1)	2riu	3,4-DIHYDROXY-2-BUTA NONE 4-PHOSPHATE SYNTHASE (Candida albicans)	4 / 7	LEU A 113 PHE A 93 PHE A 123 LEU A 70	None	0.93A	3asoP-2riuA: undetectable 3asoW-2riuA: undetectable	3asoP-2riuA: 21.66 3asoW-2riuA: 14.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.	3KP6_B_SALB3003_1 (TRANSCRIPTIONAL REGULATOR TCAR)	2riu	3,4-DIHYDROXY-2-BUTA NONE 4-PHOSPHATE SYNTHASE (Candida albicans)	4 / 6	ILE A 129 VAL A 60 LEU A 62 LEU A 70	None	0.72A	3kp6A-2riuA: undetectable 3kp6B-2riuA: undetectable	3kp6A-2riuA: 19.42 3kp6B-2riuA: 19.42
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.	3WG7_C_CHDC305_0 (CYTOCHROME C OXIDASE SUBUNIT 3 CYTOCHROME C OXIDASE SUBUNIT 7A1, MITOCHONDRIAL)	2riu	3,4-DIHYDROXY-2-BUTA NONE 4-PHOSPHATE SYNTHASE (Candida albicans)	4 / 6	LEU A 113 PHE A 93 PHE A 123 LEU A 70	None	0.91A	3wg7C-2riuA: undetectable 3wg7J-2riuA: undetectable	3wg7C-2riuA: 21.66 3wg7J-2riuA: 14.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.	3WG7_P_CHDP306_0 (CYTOCHROME C OXIDASE SUBUNIT 3 CYTOCHROME C OXIDASE SUBUNIT 7A1, MITOCHONDRIAL)	2riu	3,4-DIHYDROXY-2-BUTA NONE 4-PHOSPHATE SYNTHASE (Candida albicans)	4 / 6	LEU A 113 PHE A 93 PHE A 123 LEU A 70	None	0.95A	3wg7P-2riuA: undetectable 3wg7W-2riuA: undetectable	3wg7P-2riuA: 21.66 3wg7W-2riuA: 14.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.	3X2Q_C_CHDC304_0 (CYTOCHROME C OXIDASE SUBUNIT 3 CYTOCHROME C OXIDASE SUBUNIT 7A1, MITOCHONDRIAL)	2riu	3,4-DIHYDROXY-2-BUTA NONE 4-PHOSPHATE SYNTHASE (Candida albicans)	4 / 7	LEU A 113 PHE A 93 PHE A 123 LEU A 70	None	0.92A	3x2qC-2riuA: undetectable 3x2qJ-2riuA: undetectable	3x2qC-2riuA: 21.66 3x2qJ-2riuA: 14.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.	3X2Q_P_CHDP307_0 (CYTOCHROME C OXIDASE SUBUNIT 3 CYTOCHROME C OXIDASE SUBUNIT 7A1, MITOCHONDRIAL)	2riu	3,4-DIHYDROXY-2-BUTA NONE 4-PHOSPHATE SYNTHASE (Candida albicans)	4 / 7	LEU A 113 PHE A 93 PHE A 123 LEU A 70	None	0.89A	3x2qP-2riuA: undetectable 3x2qW-2riuA: undetectable	3x2qP-2riuA: 21.66 3x2qW-2riuA: 14.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.	4LNW_A_T3A501_2 (THYROID HORMONE RECEPTOR ALPHA)	2riu	3,4-DIHYDROXY-2-BUTA NONE 4-PHOSPHATE SYNTHASE (Candida albicans)	3 / 3	ILE A 182 MET A 176 ARG A 169	None	0.89A	4lnwA-2riuA: undetectable	4lnwA-2riuA: 20.74
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.	4LNX_A_T3A502_2 (THYROID HORMONE RECEPTOR ALPHA)	2riu	3,4-DIHYDROXY-2-BUTA NONE 4-PHOSPHATE SYNTHASE (Candida albicans)	3 / 3	ILE A 182 MET A 176 ARG A 169	None	0.90A	4lnxA-2riuA: undetectable	4lnxA-2riuA: 20.74
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.	4O1Z_B_MXMB807_1 (PROSTAGLANDIN G/H SYNTHASE 1)	2riu	3,4-DIHYDROXY-2-BUTA NONE 4-PHOSPHATE SYNTHASE (Candida albicans)	5 / 12	LEU A 198 ILE A 36 LEU A 21 ALA A 156 SER A 153	None	1.02A	4o1zB-2riuA: undetectable	4o1zB-2riuA: 16.21
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.	5B1A_C_CHDC304_0 (CYTOCHROME C OXIDASE SUBUNIT 3 CYTOCHROME C OXIDASE SUBUNIT 7A1, MITOCHONDRIAL)	2riu	3,4-DIHYDROXY-2-BUTA NONE 4-PHOSPHATE SYNTHASE (Candida albicans)	4 / 7	LEU A 113 PHE A 93 PHE A 123 LEU A 70	None	0.90A	5b1aC-2riuA: undetectable 5b1aJ-2riuA: undetectable	5b1aC-2riuA: 21.66 5b1aJ-2riuA: 14.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.	5B1A_P_CHDP305_0 (CYTOCHROME C OXIDASE SUBUNIT 3 CYTOCHROME C OXIDASE SUBUNIT 7A1, MITOCHONDRIAL)	2riu	3,4-DIHYDROXY-2-BUTA NONE 4-PHOSPHATE SYNTHASE (Candida albicans)	4 / 7	LEU A 113 PHE A 93 PHE A 123 LEU A 70	None	0.88A	5b1aP-2riuA: undetectable 5b1aW-2riuA: undetectable	5b1aP-2riuA: 21.66 5b1aW-2riuA: 14.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.	5B1B_P_CHDP306_0 (CYTOCHROME C OXIDASE SUBUNIT 3 CYTOCHROME C OXIDASE SUBUNIT 7A1, MITOCHONDRIAL)	2riu	3,4-DIHYDROXY-2-BUTA NONE 4-PHOSPHATE SYNTHASE (Candida albicans)	4 / 7	LEU A 113 PHE A 93 PHE A 123 LEU A 70	None	0.92A	5b1bP-2riuA: undetectable 5b1bW-2riuA: undetectable	5b1bP-2riuA: 21.66 5b1bW-2riuA: 14.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.	5B3S_C_CHDC307_0 (CYTOCHROME C OXIDASE SUBUNIT 3 CYTOCHROME C OXIDASE SUBUNIT 7A1, MITOCHONDRIAL)	2riu	3,4-DIHYDROXY-2-BUTA NONE 4-PHOSPHATE SYNTHASE (Candida albicans)	4 / 7	LEU A 113 PHE A 93 PHE A 123 LEU A 70	None	0.89A	5b3sC-2riuA: undetectable 5b3sJ-2riuA: undetectable	5b3sC-2riuA: 21.66 5b3sJ-2riuA: 14.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.	5B3S_P_CHDP306_0 (CYTOCHROME C OXIDASE SUBUNIT 3)	2riu	3,4-DIHYDROXY-2-BUTA NONE 4-PHOSPHATE SYNTHASE (Candida albicans)	4 / 7	LEU A 113 PHE A 93 PHE A 123 LEU A 70	None	0.90A	5b3sP-2riuA: undetectable	5b3sP-2riuA: 21.66
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.	5FCT_B_C2FB402_0 (THYMIDYLATE SYNTHASE)	2riu	3,4-DIHYDROXY-2-BUTA NONE 4-PHOSPHATE SYNTHASE (Candida albicans)	5 / 12	VAL A 51 LEU A 72 CYH A 91 MET A 37 ALA A 161	None	1.26A	5fctB-2riuA: undetectable	5fctB-2riuA: 23.18
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.	5IY5_C_CHDC307_0 (CYTOCHROME C OXIDASE SUBUNIT 3 CYTOCHROME C OXIDASE SUBUNIT 7A1, MITOCHONDRIAL)	2riu	3,4-DIHYDROXY-2-BUTA NONE 4-PHOSPHATE SYNTHASE (Candida albicans)	4 / 7	LEU A 113 PHE A 93 PHE A 123 LEU A 70	None	0.96A	5iy5C-2riuA: undetectable 5iy5J-2riuA: undetectable	5iy5C-2riuA: 22.01 5iy5J-2riuA: 14.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.	5WM7_A_ACTA603_0 (SALICYLATE-AMP LIGASE)	2riu	3,4-DIHYDROXY-2-BUTA NONE 4-PHOSPHATE SYNTHASE (Candida albicans)	4 / 4	THR A 146 THR A 85 ALA A 86 ARG A 142	5RP A 701 (-3.5A) 5RP A 701 (-3.1A) None 5RP A 701 (-3.2A)	1.50A	5wm7A-2riuA: 0.0	5wm7A-2riuA: 17.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.	5X1B_P_CHDP305_0 (CYTOCHROME C OXIDASE SUBUNIT 3)	2riu	3,4-DIHYDROXY-2-BUTA NONE 4-PHOSPHATE SYNTHASE (Candida albicans)	4 / 5	LEU A 113 PHE A 93 PHE A 123 LEU A 70	None	0.96A	5x1bP-2riuA: undetectable	5x1bP-2riuA: 21.66
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.	5X1F_P_CHDP304_0 (CYTOCHROME C OXIDASE SUBUNIT 3 CYTOCHROME C OXIDASE SUBUNIT 7A1, MITOCHONDRIAL)	2riu	3,4-DIHYDROXY-2-BUTA NONE 4-PHOSPHATE SYNTHASE (Candida albicans)	4 / 7	LEU A 113 PHE A 93 PHE A 123 LEU A 70	None	0.97A	5x1fP-2riuA: undetectable 5x1fW-2riuA: undetectable	5x1fP-2riuA: 21.66 5x1fW-2riuA: 14.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.	5Z84_C_CHDC307_0 (CYTOCHROME C OXIDASE SUBUNIT 3 CYTOCHROME C OXIDASE SUBUNIT 7A1, MITOCHONDRIAL)	2riu	3,4-DIHYDROXY-2-BUTA NONE 4-PHOSPHATE SYNTHASE (Candida albicans)	4 / 7	LEU A 113 PHE A 93 PHE A 123 LEU A 70	None	0.94A	5z84C-2riuA: undetectable 5z84J-2riuA: undetectable	5z84C-2riuA: 21.66 5z84J-2riuA: 14.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.	5Z85_C_CHDC306_0 (CYTOCHROME C OXIDASE SUBUNIT 3 CYTOCHROME C OXIDASE SUBUNIT 7A1, MITOCHONDRIAL)	2riu	3,4-DIHYDROXY-2-BUTA NONE 4-PHOSPHATE SYNTHASE (Candida albicans)	4 / 7	LEU A 113 PHE A 93 PHE A 123 LEU A 70	None	0.94A	5z85C-2riuA: undetectable 5z85J-2riuA: undetectable	5z85C-2riuA: 21.66 5z85J-2riuA: 14.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.	5ZCO_C_CHDC306_0 (CYTOCHROME C OXIDASE SUBUNIT 3 CYTOCHROME C OXIDASE SUBUNIT 7A1, MITOCHONDRIAL)	2riu	3,4-DIHYDROXY-2-BUTA NONE 4-PHOSPHATE SYNTHASE (Candida albicans)	4 / 7	LEU A 113 PHE A 93 PHE A 123 LEU A 70	None	0.94A	5zcoC-2riuA: undetectable 5zcoJ-2riuA: undetectable	5zcoC-2riuA: 21.66 5zcoJ-2riuA: 14.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.	5ZCQ_C_CHDC306_0 (CYTOCHROME C OXIDASE SUBUNIT 3 CYTOCHROME C OXIDASE SUBUNIT 7A1, MITOCHONDRIAL)	2riu	3,4-DIHYDROXY-2-BUTA NONE 4-PHOSPHATE SYNTHASE (Candida albicans)	4 / 7	LEU A 113 PHE A 93 PHE A 123 LEU A 70	None	0.94A	5zcqC-2riuA: undetectable 5zcqJ-2riuA: undetectable	5zcqC-2riuA: 21.66 5zcqJ-2riuA: 14.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.	5ZCQ_P_CHDP306_0 (CYTOCHROME C OXIDASE SUBUNIT 3 CYTOCHROME C OXIDASE SUBUNIT 7A1, MITOCHONDRIAL)	2riu	3,4-DIHYDROXY-2-BUTA NONE 4-PHOSPHATE SYNTHASE (Candida albicans)	4 / 7	LEU A 113 PHE A 93 PHE A 123 LEU A 70	None	0.91A	5zcqP-2riuA: undetectable 5zcqW-2riuA: undetectable	5zcqP-2riuA: 21.66 5zcqW-2riuA: 14.50

[["DrReposER ID","Desc.","Hit PDB","Hit molecule","Hit organism","Res. no.","Interface","HETATM","RMSD","Z-score","Seq ID"],["1V54_C_CHDC3271_0","CYTOCHROME C OXIDASE POLYPEPTIDE III;CYTOCHROME C OXIDASE POLYPEPTIDE VIIA-HEART","2riu","3,4-DIHYDROXY-2-BUTANONE 4-PHOSPHATE SYNTHASE","Candida albicans",4,"LEU A 113;PHE A  93;PHE A 123;LEU A  70","None","0.90A","1v54C-2riuA:undetectable;1v54J-2riuA:undetectable","1v54C-2riuA:21.66;1v54J-2riuA:14.50"],["1XF1_A_ACTA1107_0","C5A PEPTIDASE","2riu","3,4-DIHYDROXY-2-BUTANONE 4-PHOSPHATE SYNTHASE","Candida albicans",4,"GLY A 100;HIS A 128;ILE A 129;PHE A  93","None","0.80A","1xf1A-2riuA:undetectable","1xf1A-2riuA:12.44"],["1XF1_B_ACTB1108_0","C5A PEPTIDASE","2riu","3,4-DIHYDROXY-2-BUTANONE 4-PHOSPHATE SYNTHASE","Candida albicans",4,"GLY A 100;HIS A 128;ILE A 129;PHE A  93","None","0.80A","1xf1B-2riuA:undetectable","1xf1B-2riuA:12.44"],["2EIK_C_CHDC271_0","CYTOCHROME C OXIDASE POLYPEPTIDE VIIA-HEART;CYTOCHROME C OXIDASE SUBUNIT 3","2riu","3,4-DIHYDROXY-2-BUTANONE 4-PHOSPHATE SYNTHASE","Candida albicans",4,"LEU A 113;PHE A  93;PHE A 123;LEU A  70","None","0.92A","2eikC-2riuA:undetectable;2eikJ-2riuA:undetectable","2eikC-2riuA:21.66;2eikJ-2riuA:14.50"],["2EIL_P_CHDP1271_0","CYTOCHROME C OXIDASE POLYPEPTIDE VIIA-HEART;CYTOCHROME C OXIDASE SUBUNIT 3","2riu","3,4-DIHYDROXY-2-BUTANONE 4-PHOSPHATE SYNTHASE","Candida albicans",4,"LEU A 113;PHE A  93;PHE A 123;LEU A  70","None","0.96A","2eilP-2riuA:undetectable;2eilW-2riuA:undetectable","2eilP-2riuA:21.66;2eilW-2riuA:14.50"],["2EIM_W_CHDW1271_0","CYTOCHROME C OXIDASE POLYPEPTIDE VIIA-HEART;CYTOCHROME C OXIDASE SUBUNIT 3","2riu","3,4-DIHYDROXY-2-BUTANONE 4-PHOSPHATE SYNTHASE","Candida albicans",4,"LEU A 113;PHE A  93;PHE A 123;LEU A  70","None","0.94A","2eimP-2riuA:undetectable;2eimW-2riuA:undetectable","2eimP-2riuA:21.66;2eimW-2riuA:14.50"],["3ABK_P_CHDP1271_0","CYTOCHROME C OXIDASE POLYPEPTIDE 7A1;CYTOCHROME C OXIDASE SUBUNIT 3","2riu","3,4-DIHYDROXY-2-BUTANONE 4-PHOSPHATE SYNTHASE","Candida albicans",4,"LEU A 113;PHE A  93;PHE A 123;LEU A  70","None","0.97A","3abkP-2riuA:undetectable;3abkW-2riuA:undetectable","3abkP-2riuA:21.66;3abkW-2riuA:14.50"],["3AG2_C_CHDC271_0","CYTOCHROME C OXIDASE SUBUNIT 3","2riu","3,4-DIHYDROXY-2-BUTANONE 4-PHOSPHATE SYNTHASE","Candida albicans",4,"LEU A 113;PHE A  93;PHE A 123;LEU A  70","None","0.91A","3ag2C-2riuA:undetectable","3ag2C-2riuA:21.66"],["3AG2_P_CHDP1271_0","CYTOCHROME C OXIDASE POLYPEPTIDE 7A1;CYTOCHROME C OXIDASE SUBUNIT 3","2riu","3,4-DIHYDROXY-2-BUTANONE 4-PHOSPHATE SYNTHASE","Candida albicans",4,"LEU A 113;PHE A  93;PHE A 123;LEU A  70","None","0.93A","3ag2P-2riuA:undetectable;3ag2W-2riuA:undetectable","3ag2P-2riuA:21.66;3ag2W-2riuA:14.50"],["3AG4_C_CHDC271_0","CYTOCHROME C OXIDASE POLYPEPTIDE 7A1;CYTOCHROME C OXIDASE SUBUNIT 3","2riu","3,4-DIHYDROXY-2-BUTANONE 4-PHOSPHATE SYNTHASE","Candida albicans",4,"LEU A 113;PHE A  93;PHE A 123;LEU A  70","None","0.93A","3ag4C-2riuA:undetectable;3ag4J-2riuA:undetectable","3ag4C-2riuA:21.66;3ag4J-2riuA:14.50"],["3AG4_P_CHDP1271_0","CYTOCHROME C OXIDASE POLYPEPTIDE 7A1;CYTOCHROME C OXIDASE SUBUNIT 3","2riu","3,4-DIHYDROXY-2-BUTANONE 4-PHOSPHATE SYNTHASE","Candida albicans",4,"LEU A 113;PHE A  93;PHE A 123;LEU A  70","None","0.93A","3ag4P-2riuA:undetectable;3ag4W-2riuA:undetectable","3ag4P-2riuA:21.66;3ag4W-2riuA:14.50"],["3ASN_C_CHDC271_0","CYTOCHROME C OXIDASE SUBUNIT 3;CYTOCHROME C OXIDASE SUBUNIT 7A1","2riu","3,4-DIHYDROXY-2-BUTANONE 4-PHOSPHATE SYNTHASE","Candida albicans",4,"LEU A 113;PHE A  93;PHE A 123;LEU A  70","None","0.90A","3asnC-2riuA:undetectable;3asnJ-2riuA:undetectable","3asnC-2riuA:21.66;3asnJ-2riuA:14.50"],["3ASN_P_CHDP1271_0","CYTOCHROME C OXIDASE SUBUNIT 3;CYTOCHROME C OXIDASE SUBUNIT 7A1","2riu","3,4-DIHYDROXY-2-BUTANONE 4-PHOSPHATE SYNTHASE","Candida albicans",4,"LEU A 113;PHE A  93;PHE A 123;LEU A  70","None","0.95A","3asnP-2riuA:undetectable;3asnW-2riuA:undetectable","3asnP-2riuA:21.66;3asnW-2riuA:14.50"],["3ASO_C_CHDC271_0","CYTOCHROME C OXIDASE SUBUNIT 3;CYTOCHROME C OXIDASE SUBUNIT 7A1","2riu","3,4-DIHYDROXY-2-BUTANONE 4-PHOSPHATE SYNTHASE","Candida albicans",4,"LEU A 113;PHE A  93;PHE A 123;LEU A  70","None","0.92A","3asoC-2riuA:undetectable;3asoJ-2riuA:undetectable","3asoC-2riuA:21.66;3asoJ-2riuA:14.50"],["3ASO_P_CHDP1271_0","CYTOCHROME C OXIDASE SUBUNIT 3;CYTOCHROME C OXIDASE SUBUNIT 7A1","2riu","3,4-DIHYDROXY-2-BUTANONE 4-PHOSPHATE SYNTHASE","Candida albicans",4,"LEU A 113;PHE A  93;PHE A 123;LEU A  70","None","0.93A","3asoP-2riuA:undetectable;3asoW-2riuA:undetectable","3asoP-2riuA:21.66;3asoW-2riuA:14.50"],["3KP6_B_SALB3003_1","TRANSCRIPTIONAL REGULATOR TCAR;TRANSCRIPTIONAL REGULATOR TCAR","2riu","3,4-DIHYDROXY-2-BUTANONE 4-PHOSPHATE SYNTHASE","Candida albicans",4,"ILE A 129;VAL A  60;LEU A  62;LEU A  70","None","0.72A","3kp6A-2riuA:undetectable;3kp6B-2riuA:undetectable","3kp6A-2riuA:19.42;3kp6B-2riuA:19.42"],["3WG7_C_CHDC305_0","CYTOCHROME C OXIDASE SUBUNIT 3;CYTOCHROME C OXIDASE SUBUNIT 7A1, MITOCHONDRIAL","2riu","3,4-DIHYDROXY-2-BUTANONE 4-PHOSPHATE SYNTHASE","Candida albicans",4,"LEU A 113;PHE A  93;PHE A 123;LEU A  70","None","0.91A","3wg7C-2riuA:undetectable;3wg7J-2riuA:undetectable","3wg7C-2riuA:21.66;3wg7J-2riuA:14.50"],["3WG7_P_CHDP306_0","CYTOCHROME C OXIDASE SUBUNIT 3;CYTOCHROME C OXIDASE SUBUNIT 7A1, MITOCHONDRIAL","2riu","3,4-DIHYDROXY-2-BUTANONE 4-PHOSPHATE SYNTHASE","Candida albicans",4,"LEU A 113;PHE A  93;PHE A 123;LEU A  70","None","0.95A","3wg7P-2riuA:undetectable;3wg7W-2riuA:undetectable","3wg7P-2riuA:21.66;3wg7W-2riuA:14.50"],["3X2Q_C_CHDC304_0","CYTOCHROME C OXIDASE SUBUNIT 3;CYTOCHROME C OXIDASE SUBUNIT 7A1, MITOCHONDRIAL","2riu","3,4-DIHYDROXY-2-BUTANONE 4-PHOSPHATE SYNTHASE","Candida albicans",4,"LEU A 113;PHE A  93;PHE A 123;LEU A  70","None","0.92A","3x2qC-2riuA:undetectable;3x2qJ-2riuA:undetectable","3x2qC-2riuA:21.66;3x2qJ-2riuA:14.50"],["3X2Q_P_CHDP307_0","CYTOCHROME C OXIDASE SUBUNIT 3;CYTOCHROME C OXIDASE SUBUNIT 7A1, MITOCHONDRIAL","2riu","3,4-DIHYDROXY-2-BUTANONE 4-PHOSPHATE SYNTHASE","Candida albicans",4,"LEU A 113;PHE A  93;PHE A 123;LEU A  70","None","0.89A","3x2qP-2riuA:undetectable;3x2qW-2riuA:undetectable","3x2qP-2riuA:21.66;3x2qW-2riuA:14.50"],["4LNW_A_T3A501_2","THYROID HORMONE RECEPTOR ALPHA","2riu","3,4-DIHYDROXY-2-BUTANONE 4-PHOSPHATE SYNTHASE","Candida albicans",3,"ILE A 182;MET A 176;ARG A 169","None","0.89A","4lnwA-2riuA:undetectable","4lnwA-2riuA:20.74"],["4LNX_A_T3A502_2","THYROID HORMONE RECEPTOR ALPHA","2riu","3,4-DIHYDROXY-2-BUTANONE 4-PHOSPHATE SYNTHASE","Candida albicans",3,"ILE A 182;MET A 176;ARG A 169","None","0.90A","4lnxA-2riuA:undetectable","4lnxA-2riuA:20.74"],["4O1Z_B_MXMB807_1","PROSTAGLANDIN G\/H SYNTHASE 1","2riu","3,4-DIHYDROXY-2-BUTANONE 4-PHOSPHATE SYNTHASE","Candida albicans",5,"LEU A 198;ILE A  36;LEU A  21;ALA A 156;SER A 153","None","1.02A","4o1zB-2riuA:undetectable","4o1zB-2riuA:16.21"],["5B1A_C_CHDC304_0","CYTOCHROME C OXIDASE SUBUNIT 3;CYTOCHROME C OXIDASE SUBUNIT 7A1, MITOCHONDRIAL","2riu","3,4-DIHYDROXY-2-BUTANONE 4-PHOSPHATE SYNTHASE","Candida albicans",4,"LEU A 113;PHE A  93;PHE A 123;LEU A  70","None","0.90A","5b1aC-2riuA:undetectable;5b1aJ-2riuA:undetectable","5b1aC-2riuA:21.66;5b1aJ-2riuA:14.50"],["5B1A_P_CHDP305_0","CYTOCHROME C OXIDASE SUBUNIT 3;CYTOCHROME C OXIDASE SUBUNIT 7A1, MITOCHONDRIAL","2riu","3,4-DIHYDROXY-2-BUTANONE 4-PHOSPHATE SYNTHASE","Candida albicans",4,"LEU A 113;PHE A  93;PHE A 123;LEU A  70","None","0.88A","5b1aP-2riuA:undetectable;5b1aW-2riuA:undetectable","5b1aP-2riuA:21.66;5b1aW-2riuA:14.50"],["5B1B_P_CHDP306_0","CYTOCHROME C OXIDASE SUBUNIT 3;CYTOCHROME C OXIDASE SUBUNIT 7A1, MITOCHONDRIAL","2riu","3,4-DIHYDROXY-2-BUTANONE 4-PHOSPHATE SYNTHASE","Candida albicans",4,"LEU A 113;PHE A  93;PHE A 123;LEU A  70","None","0.92A","5b1bP-2riuA:undetectable;5b1bW-2riuA:undetectable","5b1bP-2riuA:21.66;5b1bW-2riuA:14.50"],["5B3S_C_CHDC307_0","CYTOCHROME C OXIDASE SUBUNIT 3;CYTOCHROME C OXIDASE SUBUNIT 7A1, MITOCHONDRIAL","2riu","3,4-DIHYDROXY-2-BUTANONE 4-PHOSPHATE SYNTHASE","Candida albicans",4,"LEU A 113;PHE A  93;PHE A 123;LEU A  70","None","0.89A","5b3sC-2riuA:undetectable;5b3sJ-2riuA:undetectable","5b3sC-2riuA:21.66;5b3sJ-2riuA:14.50"],["5B3S_P_CHDP306_0","CYTOCHROME C OXIDASE SUBUNIT 3","2riu","3,4-DIHYDROXY-2-BUTANONE 4-PHOSPHATE SYNTHASE","Candida albicans",4,"LEU A 113;PHE A  93;PHE A 123;LEU A  70","None","0.90A","5b3sP-2riuA:undetectable","5b3sP-2riuA:21.66"],["5FCT_B_C2FB402_0","THYMIDYLATE SYNTHASE","2riu","3,4-DIHYDROXY-2-BUTANONE 4-PHOSPHATE SYNTHASE","Candida albicans",5,"VAL A  51;LEU A  72;CYH A  91;MET A  37;ALA A 161","None","1.26A","5fctB-2riuA:undetectable","5fctB-2riuA:23.18"],["5IY5_C_CHDC307_0","CYTOCHROME C OXIDASE SUBUNIT 3;CYTOCHROME C OXIDASE SUBUNIT 7A1, MITOCHONDRIAL","2riu","3,4-DIHYDROXY-2-BUTANONE 4-PHOSPHATE SYNTHASE","Candida albicans",4,"LEU A 113;PHE A  93;PHE A 123;LEU A  70","None","0.96A","5iy5C-2riuA:undetectable;5iy5J-2riuA:undetectable","5iy5C-2riuA:22.01;5iy5J-2riuA:14.50"],["5WM7_A_ACTA603_0","SALICYLATE-AMP LIGASE","2riu","3,4-DIHYDROXY-2-BUTANONE 4-PHOSPHATE SYNTHASE","Candida albicans",4,"THR A 146;THR A  85;ALA A  86;ARG A 142","5RP A 701 (-3.5A);5RP A 701 (-3.1A);None;5RP A 701 (-3.2A)","1.50A","5wm7A-2riuA:0.0","5wm7A-2riuA:17.17"],["5X1B_P_CHDP305_0","CYTOCHROME C OXIDASE SUBUNIT 3","2riu","3,4-DIHYDROXY-2-BUTANONE 4-PHOSPHATE SYNTHASE","Candida albicans",4,"LEU A 113;PHE A  93;PHE A 123;LEU A  70","None","0.96A","5x1bP-2riuA:undetectable","5x1bP-2riuA:21.66"],["5X1F_P_CHDP304_0","CYTOCHROME C OXIDASE SUBUNIT 3;CYTOCHROME C OXIDASE SUBUNIT 7A1, MITOCHONDRIAL","2riu","3,4-DIHYDROXY-2-BUTANONE 4-PHOSPHATE SYNTHASE","Candida albicans",4,"LEU A 113;PHE A  93;PHE A 123;LEU A  70","None","0.97A","5x1fP-2riuA:undetectable;5x1fW-2riuA:undetectable","5x1fP-2riuA:21.66;5x1fW-2riuA:14.50"],["5Z84_C_CHDC307_0","CYTOCHROME C OXIDASE SUBUNIT 3;CYTOCHROME C OXIDASE SUBUNIT 7A1, MITOCHONDRIAL","2riu","3,4-DIHYDROXY-2-BUTANONE 4-PHOSPHATE SYNTHASE","Candida albicans",4,"LEU A 113;PHE A  93;PHE A 123;LEU A  70","None","0.94A","5z84C-2riuA:undetectable;5z84J-2riuA:undetectable","5z84C-2riuA:21.66;5z84J-2riuA:14.50"],["5Z85_C_CHDC306_0","CYTOCHROME C OXIDASE SUBUNIT 3;CYTOCHROME C OXIDASE SUBUNIT 7A1, MITOCHONDRIAL","2riu","3,4-DIHYDROXY-2-BUTANONE 4-PHOSPHATE SYNTHASE","Candida albicans",4,"LEU A 113;PHE A  93;PHE A 123;LEU A  70","None","0.94A","5z85C-2riuA:undetectable;5z85J-2riuA:undetectable","5z85C-2riuA:21.66;5z85J-2riuA:14.50"],["5ZCO_C_CHDC306_0","CYTOCHROME C OXIDASE SUBUNIT 3;CYTOCHROME C OXIDASE SUBUNIT 7A1, MITOCHONDRIAL","2riu","3,4-DIHYDROXY-2-BUTANONE 4-PHOSPHATE SYNTHASE","Candida albicans",4,"LEU A 113;PHE A  93;PHE A 123;LEU A  70","None","0.94A","5zcoC-2riuA:undetectable;5zcoJ-2riuA:undetectable","5zcoC-2riuA:21.66;5zcoJ-2riuA:14.50"],["5ZCQ_C_CHDC306_0","CYTOCHROME C OXIDASE SUBUNIT 3;CYTOCHROME C OXIDASE SUBUNIT 7A1, MITOCHONDRIAL","2riu","3,4-DIHYDROXY-2-BUTANONE 4-PHOSPHATE SYNTHASE","Candida albicans",4,"LEU A 113;PHE A  93;PHE A 123;LEU A  70","None","0.94A","5zcqC-2riuA:undetectable;5zcqJ-2riuA:undetectable","5zcqC-2riuA:21.66;5zcqJ-2riuA:14.50"],["5ZCQ_P_CHDP306_0","CYTOCHROME C OXIDASE SUBUNIT 3;CYTOCHROME C OXIDASE SUBUNIT 7A1, MITOCHONDRIAL","2riu","3,4-DIHYDROXY-2-BUTANONE 4-PHOSPHATE SYNTHASE","Candida albicans",4,"LEU A 113;PHE A  93;PHE A 123;LEU A  70","None","0.91A","5zcqP-2riuA:undetectable;5zcqW-2riuA:undetectable","5zcqP-2riuA:21.66;5zcqW-2riuA:14.50"]]