SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4wcj'

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)

Filter list by:

	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.	1C3S_A_SHHA952_1 (HDLP (HISTONE DEACETYLASE-LIKE PROTEIN))	4wcj	POLYSACCHARIDE DEACETYLASE (Ammonifex degensii)	5 / 11	PRO A 187 PHE A 189 HIS A 173 PHE A 220 TYR A 224	None None ZN A 301 (-3.3A) None None	1.39A	1c3sA-4wcjA: undetectable	1c3sA-4wcjA: 20.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.	1HRK_A_CHDA1502_0 (FERROCHELATASE)	4wcj	POLYSACCHARIDE DEACETYLASE (Ammonifex degensii)	4 / 8	MET A 162 VAL A 144 GLY A 145 TRP A 156	None	0.98A	1hrkA-4wcjA: undetectable	1hrkA-4wcjA: 21.55
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.	1HRK_B_CHDB2502_0 (FERROCHELATASE)	4wcj	POLYSACCHARIDE DEACETYLASE (Ammonifex degensii)	4 / 8	MET A 162 VAL A 144 GLY A 145 TRP A 156	None	0.98A	1hrkB-4wcjA: undetectable	1hrkB-4wcjA: 21.55
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.	1Q23_F_FUAF704_1 (CHLORAMPHENICOL ACETYLTRANSFERASE)	4wcj	POLYSACCHARIDE DEACETYLASE (Ammonifex degensii)	5 / 11	THR A 265 SER A 268 VAL A 109 VAL A 272 THR A 31	None	1.36A	1q23F-4wcjA: undetectable	1q23F-4wcjA: 18.52
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.	1Q23_L_FUAL710_2 (CHLORAMPHENICOL ACETYLTRANSFERASE)	4wcj	POLYSACCHARIDE DEACETYLASE (Ammonifex degensii)	5 / 11	THR A 265 SER A 268 LEU A 33 VAL A 250 VAL A 272	None	1.43A	1q23L-4wcjA: undetectable	1q23L-4wcjA: 18.52
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.	1R9O_A_FLPA501_1 (CYTOCHROME P450 2C9)	4wcj	POLYSACCHARIDE DEACETYLASE (Ammonifex degensii)	5 / 12	LEU A 38 ASP A 96 GLY A 100 ALA A 99 LEU A 242	None	1.07A	1r9oA-4wcjA: undetectable	1r9oA-4wcjA: 20.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.	2E1Q_B_SALB3006_1 (XANTHINE DEHYDROGENASE/OXIDAS E)	4wcj	POLYSACCHARIDE DEACETYLASE (Ammonifex degensii)	4 / 4	ARG A 261 PHE A 244 THR A 112 ALA A 221	None	1.05A	2e1qB-4wcjA: 0.0	2e1qB-4wcjA: 12.00
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.	2E1Q_C_SALC4006_1 (XANTHINE DEHYDROGENASE/OXIDAS E)	4wcj	POLYSACCHARIDE DEACETYLASE (Ammonifex degensii)	4 / 6	ARG A 261 PHE A 244 THR A 112 ALA A 221	None	1.06A	2e1qC-4wcjA: undetectable	2e1qC-4wcjA: 12.00
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.	2E1Q_D_SALD5006_1 (XANTHINE DEHYDROGENASE/OXIDAS E)	4wcj	POLYSACCHARIDE DEACETYLASE (Ammonifex degensii)	4 / 5	ARG A 261 PHE A 244 THR A 112 ALA A 221	None	1.08A	2e1qD-4wcjA: undetectable	2e1qD-4wcjA: 12.00
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.	2QD3_A_CHDA502_0 (FERROCHELATASE)	4wcj	POLYSACCHARIDE DEACETYLASE (Ammonifex degensii)	4 / 8	MET A 162 VAL A 144 GLY A 145 TRP A 156	None	0.95A	2qd3A-4wcjA: undetectable	2qd3A-4wcjA: 21.55
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.	2VQY_A_PARA1201_2 (AAC(6')-IB)	4wcj	POLYSACCHARIDE DEACETYLASE (Ammonifex degensii)	3 / 3	TRP A 156 GLN A 158 TRP A 148	None	1.30A	2vqyA-4wcjA: 0.3	2vqyA-4wcjA: 22.96
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.	2XFH_A_CL6A1413_1 (ERYTHROMYCIN B/D C-12 HYDROXYLASE)	4wcj	POLYSACCHARIDE DEACETYLASE (Ammonifex degensii)	4 / 6	ALA A 199 ALA A 203 THR A 206 PHE A 240	None	1.06A	2xfhA-4wcjA: undetectable	2xfhA-4wcjA: 20.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.	2ZD1_A_T27A557_1 (REVERSE TRANSCRIPTASE/RIBONU CLEASE H)	4wcj	POLYSACCHARIDE DEACETYLASE (Ammonifex degensii)	5 / 12	LEU A 242 VAL A 89 VAL A 40 TYR A 97 TYR A 219	None	1.31A	2zd1A-4wcjA: undetectable	2zd1A-4wcjA: 18.89
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.	3AI8_A_HNQA255_1 (CATHEPSIN B)	4wcj	POLYSACCHARIDE DEACETYLASE (Ammonifex degensii)	4 / 7	GLY A 225 HIS A 44 CYH A 42 HIS A 178	None None None ZN A 301 (-3.3A)	1.08A	3ai8A-4wcjA: undetectable	3ai8A-4wcjA: 19.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.	3AQI_A_CHDA2_0 (FERROCHELATASE)	4wcj	POLYSACCHARIDE DEACETYLASE (Ammonifex degensii)	4 / 6	MET A 162 ARG A 122 GLY A 145 TRP A 156	None CL A 302 ( 4.8A) None None	1.50A	3aqiA-4wcjA: undetectable	3aqiA-4wcjA: 21.55
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.	3M8P_A_65BA562_0 (REVERSE TRANSCRIPTASE/RIBONU CLEASE H P51 RT)	4wcj	POLYSACCHARIDE DEACETYLASE (Ammonifex degensii)	5 / 11	LEU A 242 VAL A 89 VAL A 40 TYR A 97 TYR A 219	None	1.33A	3m8pA-4wcjA: undetectable 3m8pB-4wcjA: 1.6	3m8pA-4wcjA: 18.49 3m8pB-4wcjA: 21.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.	3NS1_C_PM6C1_1 (XANTHINE DEHYDROGENASE/OXIDAS E)	4wcj	POLYSACCHARIDE DEACETYLASE (Ammonifex degensii)	4 / 6	ARG A 261 PHE A 244 THR A 112 ALA A 221	None	1.08A	3ns1C-4wcjA: undetectable	3ns1C-4wcjA: 16.23
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.	3U9F_B_CLMB221_0 (CHLORAMPHENICOL ACETYLTRANSFERASE)	4wcj	POLYSACCHARIDE DEACETYLASE (Ammonifex degensii)	5 / 12	THR A 265 SER A 268 LEU A 33 VAL A 250 VAL A 272	None	1.40A	3u9fB-4wcjA: undetectable 3u9fC-4wcjA: undetectable	3u9fB-4wcjA: 18.52 3u9fC-4wcjA: 18.52
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.	3U9F_E_CLME221_0 (CHLORAMPHENICOL ACETYLTRANSFERASE)	4wcj	POLYSACCHARIDE DEACETYLASE (Ammonifex degensii)	5 / 10	THR A 265 SER A 268 LEU A 33 VAL A 250 VAL A 272	None	1.45A	3u9fE-4wcjA: undetectable	3u9fE-4wcjA: 18.52
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.	3U9F_I_CLMI221_1 (CHLORAMPHENICOL ACETYLTRANSFERASE)	4wcj	POLYSACCHARIDE DEACETYLASE (Ammonifex degensii)	5 / 10	THR A 265 SER A 268 LEU A 33 VAL A 250 VAL A 272	None	1.45A	3u9fI-4wcjA: undetectable	3u9fI-4wcjA: 18.52
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.	3U9F_K_CLMK221_0 (CHLORAMPHENICOL ACETYLTRANSFERASE)	4wcj	POLYSACCHARIDE DEACETYLASE (Ammonifex degensii)	5 / 10	THR A 265 SER A 268 LEU A 33 VAL A 250 VAL A 272	None	1.41A	3u9fK-4wcjA: undetectable	3u9fK-4wcjA: 18.52
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.	3U9F_P_CLMP221_0 (CHLORAMPHENICOL ACETYLTRANSFERASE)	4wcj	POLYSACCHARIDE DEACETYLASE (Ammonifex degensii)	5 / 9	THR A 265 SER A 268 LEU A 33 VAL A 250 VAL A 272	None	1.44A	3u9fP-4wcjA: undetectable	3u9fP-4wcjA: 18.52
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.	3U9F_S_CLMS221_0 (CHLORAMPHENICOL ACETYLTRANSFERASE)	4wcj	POLYSACCHARIDE DEACETYLASE (Ammonifex degensii)	5 / 12	THR A 265 SER A 268 LEU A 33 VAL A 250 VAL A 272	None	1.40A	3u9fP-4wcjA: undetectable 3u9fS-4wcjA: undetectable	3u9fP-4wcjA: 18.52 3u9fS-4wcjA: 18.52
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.	4FGK_A_0TXA302_0 (RIBOSYLDIHYDRONICOTI NAMIDE DEHYDROGENASE [QUINONE])	4wcj	POLYSACCHARIDE DEACETYLASE (Ammonifex degensii)	4 / 6	ILE A 133 PRO A 134 PHE A 135 PHE A 113	None	0.95A	4fgkA-4wcjA: undetectable	4fgkA-4wcjA: 23.08
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.	4G1Q_A_T27A601_1 (REVERSE TRANSCRIPTASE/RIBONU CLEASE H)	4wcj	POLYSACCHARIDE DEACETYLASE (Ammonifex degensii)	5 / 12	LEU A 242 VAL A 89 VAL A 40 TYR A 97 TYR A 219	None	1.31A	4g1qA-4wcjA: undetectable	4g1qA-4wcjA: 18.89
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.	4ICL_A_T27A601_1 (REVERSE TRANSCRIPTASE/RIBONU CLEASE H)	4wcj	POLYSACCHARIDE DEACETYLASE (Ammonifex degensii)	5 / 12	LEU A 242 VAL A 89 VAL A 40 TYR A 97 TYR A 219	None	1.31A	4iclA-4wcjA: 1.5	4iclA-4wcjA: 18.89
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.	4ID5_A_T27A601_1 (REVERSE TRANSCRIPTASE/RIBONU CLEASE H)	4wcj	POLYSACCHARIDE DEACETYLASE (Ammonifex degensii)	5 / 12	LEU A 242 VAL A 89 VAL A 40 TYR A 97 TYR A 219	None	1.31A	4id5A-4wcjA: undetectable	4id5A-4wcjA: 18.89
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.	4IDK_A_T27A601_1 (REVERSE TRANSCRIPTASE/RIBONU CLEASE H)	4wcj	POLYSACCHARIDE DEACETYLASE (Ammonifex degensii)	5 / 12	LEU A 242 VAL A 89 VAL A 40 TYR A 97 TYR A 219	None	1.31A	4idkA-4wcjA: 0.3	4idkA-4wcjA: 18.89
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.	4IFV_A_T27A601_1 (EXORIBONUCLEASE H, P66 RT)	4wcj	POLYSACCHARIDE DEACETYLASE (Ammonifex degensii)	5 / 12	LEU A 242 VAL A 89 VAL A 40 TYR A 97 TYR A 219	None	1.29A	4ifvA-4wcjA: 1.4	4ifvA-4wcjA: 18.89
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.	4IFY_A_T27A601_1 (REVERSE TRANSCRIPTASE/RIBONU CLEASE H)	4wcj	POLYSACCHARIDE DEACETYLASE (Ammonifex degensii)	5 / 12	LEU A 242 VAL A 89 VAL A 40 TYR A 97 TYR A 219	None	1.31A	4ifyA-4wcjA: 1.4	4ifyA-4wcjA: 18.89
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.	4IG3_A_T27A601_1 (REVERSE TRANSCRIPTASE/RIBONU CLEASE H)	4wcj	POLYSACCHARIDE DEACETYLASE (Ammonifex degensii)	5 / 12	LEU A 242 VAL A 89 VAL A 40 TYR A 97 TYR A 219	None	1.33A	4ig3A-4wcjA: undetectable	4ig3A-4wcjA: 18.89
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.	4KFB_A_T27A607_1 (REVERSE TRANSCRIPTASE/RIBONU CLEASE H, EXORIBONUCLEA P66 RT)	4wcj	POLYSACCHARIDE DEACETYLASE (Ammonifex degensii)	5 / 12	LEU A 242 VAL A 89 VAL A 40 TYR A 97 TYR A 219	None	1.34A	4kfbA-4wcjA: 1.5	4kfbA-4wcjA: 18.89
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.	4LV9_A_20JA601_1 (NICOTINAMIDE PHOSPHORIBOSYLTRANSF ERASE)	4wcj	POLYSACCHARIDE DEACETYLASE (Ammonifex degensii)	4 / 8	PHE A 151 ASP A 117 SER A 119 ALA A 68	None	1.10A	4lv9A-4wcjA: 3.2 4lv9B-4wcjA: 3.1	4lv9A-4wcjA: 18.33 4lv9B-4wcjA: 18.33
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.	4LV9_B_20JB601_1 (NICOTINAMIDE PHOSPHORIBOSYLTRANSF ERASE)	4wcj	POLYSACCHARIDE DEACETYLASE (Ammonifex degensii)	4 / 7	PHE A 151 ASP A 117 SER A 119 ALA A 68	None	1.12A	4lv9A-4wcjA: 3.2 4lv9B-4wcjA: 3.1	4lv9A-4wcjA: 18.33 4lv9B-4wcjA: 18.33
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.	4PST_A_FOLA201_1 (DIHYDROFOLATE REDUCTASE)	4wcj	POLYSACCHARIDE DEACETYLASE (Ammonifex degensii)	3 / 3	ILE A 140 ASP A 201 ARG A 146	None	0.71A	4pstA-4wcjA: undetectable	4pstA-4wcjA: 22.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.	5CYM_A_T27A601_1 (HIV-1 REVERSE TRANSCRIPTASE, P66 SUBUNIT)	4wcj	POLYSACCHARIDE DEACETYLASE (Ammonifex degensii)	5 / 12	LEU A 242 VAL A 89 VAL A 40 TYR A 97 TYR A 219	None	1.33A	5cymA-4wcjA: 1.5	5cymA-4wcjA: 18.89
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.	5CYQ_A_T27A601_1 (HIV-1 REVERSE TRANSCRIPTASE, P66 SUBUNIT)	4wcj	POLYSACCHARIDE DEACETYLASE (Ammonifex degensii)	5 / 12	LEU A 242 VAL A 89 VAL A 40 TYR A 97 TYR A 219	None	1.35A	5cyqA-4wcjA: 1.5	5cyqA-4wcjA: 18.89
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.	5NCD_A_ACTA301_0 (PEPTIDOGLYCAN N-ACETYLGLUCOSAMINE DEACETYLASE)	4wcj	POLYSACCHARIDE DEACETYLASE (Ammonifex degensii)	5 / 6	ASP A 114 ASP A 115 HIS A 173 HIS A 178 HIS A 44	ZN A 301 ( 4.8A) ZN A 301 (-2.7A) ZN A 301 (-3.3A) ZN A 301 (-3.3A) None	0.38A	5ncdA-4wcjA: 10.0 5ncdD-4wcjA: 4.6	5ncdA-4wcjA: 21.07 5ncdD-4wcjA: 21.07
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.	5NCD_C_ACTC301_0 (PEPTIDOGLYCAN N-ACETYLGLUCOSAMINE DEACETYLASE)	4wcj	POLYSACCHARIDE DEACETYLASE (Ammonifex degensii)	5 / 6	ASP A 114 ASP A 115 HIS A 173 HIS A 178 HIS A 44	ZN A 301 ( 4.8A) ZN A 301 (-2.7A) ZN A 301 (-3.3A) ZN A 301 (-3.3A) None	0.35A	5ncdB-4wcjA: 10.1 5ncdC-4wcjA: 10.1	5ncdB-4wcjA: 21.07 5ncdC-4wcjA: 21.07
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.	5NCD_D_ACTD301_0 (PEPTIDOGLYCAN N-ACETYLGLUCOSAMINE DEACETYLASE)	4wcj	POLYSACCHARIDE DEACETYLASE (Ammonifex degensii)	4 / 4	ASP A 114 HIS A 173 HIS A 178 HIS A 44	ZN A 301 ( 4.8A) ZN A 301 (-3.3A) ZN A 301 (-3.3A) None	0.28A	5ncdD-4wcjA: 4.6	5ncdD-4wcjA: 21.07
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.	5NEK_B_AZMB302_1 (PEPTIDOGLYCAN N-ACETYLGLUCOSAMINE DEACETYLASE)	4wcj	POLYSACCHARIDE DEACETYLASE (Ammonifex degensii)	6 / 8	ASP A 114 ASP A 115 HIS A 173 HIS A 178 PRO A 223 HIS A 44	ZN A 301 ( 4.8A) ZN A 301 (-2.7A) ZN A 301 (-3.3A) ZN A 301 (-3.3A) None None	0.37A	5nekB-4wcjA: 10.0	5nekB-4wcjA: 13.58
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.	5NEK_D_AZMD302_1 (PEPTIDOGLYCAN N-ACETYLGLUCOSAMINE DEACETYLASE)	4wcj	POLYSACCHARIDE DEACETYLASE (Ammonifex degensii)	5 / 8	ASP A 114 ASP A 115 HIS A 173 HIS A 178 HIS A 44	ZN A 301 ( 4.8A) ZN A 301 (-2.7A) ZN A 301 (-3.3A) ZN A 301 (-3.3A) None	0.46A	5nekD-4wcjA: 10.1	5nekD-4wcjA: 13.58
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.	5NEL_A_ACTA302_0 (PEPTIDOGLYCAN N-ACETYLGLUCOSAMINE DEACETYLASE)	4wcj	POLYSACCHARIDE DEACETYLASE (Ammonifex degensii)	5 / 6	ASP A 114 ASP A 115 HIS A 173 HIS A 178 HIS A 44	ZN A 301 ( 4.8A) ZN A 301 (-2.7A) ZN A 301 (-3.3A) ZN A 301 (-3.3A) None	0.44A	5nelA-4wcjA: 4.7 5nelD-4wcjA: 4.1	5nelA-4wcjA: 21.07 5nelD-4wcjA: 21.07
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.	5NEL_C_ACTC302_0 (PEPTIDOGLYCAN N-ACETYLGLUCOSAMINE DEACETYLASE)	4wcj	POLYSACCHARIDE DEACETYLASE (Ammonifex degensii)	4 / 6	ASP A 114 HIS A 173 HIS A 178 HIS A 44	ZN A 301 ( 4.8A) ZN A 301 (-3.3A) ZN A 301 (-3.3A) None	0.30A	5nelB-4wcjA: 9.9 5nelC-4wcjA: 10.1	5nelB-4wcjA: 21.07 5nelC-4wcjA: 21.07
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.	5OEX_B_CUB601_0 (THIOCYANATE DEHYDROGENASE)	4wcj	POLYSACCHARIDE DEACETYLASE (Ammonifex degensii)	3 / 3	HIS A 44 ASP A 115 HIS A 173	None ZN A 301 (-2.7A) ZN A 301 (-3.3A)	0.70A	5oexB-4wcjA: undetectable	5oexB-4wcjA: 21.06
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.	5OEX_C_CUC601_0 (THIOCYANATE DEHYDROGENASE)	4wcj	POLYSACCHARIDE DEACETYLASE (Ammonifex degensii)	3 / 3	HIS A 44 ASP A 115 HIS A 173	None ZN A 301 (-2.7A) ZN A 301 (-3.3A)	0.68A	5oexC-4wcjA: undetectable	5oexC-4wcjA: 21.06
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.	5OEX_D_CUD601_0 (THIOCYANATE DEHYDROGENASE)	4wcj	POLYSACCHARIDE DEACETYLASE (Ammonifex degensii)	3 / 3	HIS A 44 ASP A 115 HIS A 173	None ZN A 301 (-2.7A) ZN A 301 (-3.3A)	0.68A	5oexD-4wcjA: undetectable	5oexD-4wcjA: 21.06
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.	5WHY_A_SAMA504_0 (RADICAL SAM DOMAIN PROTEIN)	4wcj	POLYSACCHARIDE DEACETYLASE (Ammonifex degensii)	5 / 11	TYR A 43 CYH A 42 THR A 31 SER A 268 VAL A 111	None	1.46A	5whyA-4wcjA: 4.3	5whyA-4wcjA: 17.94
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.	6ELI_A_T27A701_1 (REVERSE TRANSCRIPTASE)	4wcj	POLYSACCHARIDE DEACETYLASE (Ammonifex degensii)	5 / 12	LEU A 242 VAL A 89 VAL A 40 TYR A 97 TYR A 219	None	1.31A	6eliA-4wcjA: undetectable	6eliA-4wcjA: 15.42

[["DrReposER ID","Desc.","Hit PDB","Hit molecule","Hit organism","Res. no.","Interface","HETATM","RMSD","Z-score","Seq ID"],["1C3S_A_SHHA952_1","HDLP (HISTONE DEACETYLASE-LIKE PROTEIN)","4wcj","POLYSACCHARIDE DEACETYLASE","Ammonifex degensii",5,"PRO A 187;PHE A 189;HIS A 173;PHE A 220;TYR A 224","None;None; ZN A 301 (-3.3A);None;None","1.39A","1c3sA-4wcjA:undetectable","1c3sA-4wcjA:20.73"],["1HRK_A_CHDA1502_0","FERROCHELATASE","4wcj","POLYSACCHARIDE DEACETYLASE","Ammonifex degensii",4,"MET A 162;VAL A 144;GLY A 145;TRP A 156","None","0.98A","1hrkA-4wcjA:undetectable","1hrkA-4wcjA:21.55"],["1HRK_B_CHDB2502_0","FERROCHELATASE","4wcj","POLYSACCHARIDE DEACETYLASE","Ammonifex degensii",4,"MET A 162;VAL A 144;GLY A 145;TRP A 156","None","0.98A","1hrkB-4wcjA:undetectable","1hrkB-4wcjA:21.55"],["1Q23_F_FUAF704_1","CHLORAMPHENICOL ACETYLTRANSFERASE","4wcj","POLYSACCHARIDE DEACETYLASE","Ammonifex degensii",5,"THR A 265;SER A 268;VAL A 109;VAL A 272;THR A  31","None","1.36A","1q23F-4wcjA:undetectable","1q23F-4wcjA:18.52"],["1Q23_L_FUAL710_2","CHLORAMPHENICOL ACETYLTRANSFERASE","4wcj","POLYSACCHARIDE DEACETYLASE","Ammonifex degensii",5,"THR A 265;SER A 268;LEU A  33;VAL A 250;VAL A 272","None","1.43A","1q23L-4wcjA:undetectable","1q23L-4wcjA:18.52"],["1R9O_A_FLPA501_1","CYTOCHROME P450 2C9","4wcj","POLYSACCHARIDE DEACETYLASE","Ammonifex degensii",5,"LEU A  38;ASP A  96;GLY A 100;ALA A  99;LEU A 242","None","1.07A","1r9oA-4wcjA:undetectable","1r9oA-4wcjA:20.54"],["2E1Q_B_SALB3006_1","XANTHINE DEHYDROGENASE\/OXIDASE","4wcj","POLYSACCHARIDE DEACETYLASE","Ammonifex degensii",4,"ARG A 261;PHE A 244;THR A 112;ALA A 221","None","1.05A","2e1qB-4wcjA:0.0","2e1qB-4wcjA:12.00"],["2E1Q_C_SALC4006_1","XANTHINE DEHYDROGENASE\/OXIDASE","4wcj","POLYSACCHARIDE DEACETYLASE","Ammonifex degensii",4,"ARG A 261;PHE A 244;THR A 112;ALA A 221","None","1.06A","2e1qC-4wcjA:undetectable","2e1qC-4wcjA:12.00"],["2E1Q_D_SALD5006_1","XANTHINE DEHYDROGENASE\/OXIDASE","4wcj","POLYSACCHARIDE DEACETYLASE","Ammonifex degensii",4,"ARG A 261;PHE A 244;THR A 112;ALA A 221","None","1.08A","2e1qD-4wcjA:undetectable","2e1qD-4wcjA:12.00"],["2QD3_A_CHDA502_0","FERROCHELATASE","4wcj","POLYSACCHARIDE DEACETYLASE","Ammonifex degensii",4,"MET A 162;VAL A 144;GLY A 145;TRP A 156","None","0.95A","2qd3A-4wcjA:undetectable","2qd3A-4wcjA:21.55"],["2VQY_A_PARA1201_2","AAC(6')-IB","4wcj","POLYSACCHARIDE DEACETYLASE","Ammonifex degensii",3,"TRP A 156;GLN A 158;TRP A 148","None","1.30A","2vqyA-4wcjA:0.3","2vqyA-4wcjA:22.96"],["2XFH_A_CL6A1413_1","ERYTHROMYCIN B\/D C-12 HYDROXYLASE","4wcj","POLYSACCHARIDE DEACETYLASE","Ammonifex degensii",4,"ALA A 199;ALA A 203;THR A 206;PHE A 240","None","1.06A","2xfhA-4wcjA:undetectable","2xfhA-4wcjA:20.38"],["2ZD1_A_T27A557_1","REVERSE TRANSCRIPTASE\/RIBONUCLEASE H","4wcj","POLYSACCHARIDE DEACETYLASE","Ammonifex degensii",5,"LEU A 242;VAL A  89;VAL A  40;TYR A  97;TYR A 219","None","1.31A","2zd1A-4wcjA:undetectable","2zd1A-4wcjA:18.89"],["3AI8_A_HNQA255_1","CATHEPSIN B","4wcj","POLYSACCHARIDE DEACETYLASE","Ammonifex degensii",4,"GLY A 225;HIS A  44;CYH A  42;HIS A 178","None;None;None; ZN A 301 (-3.3A)","1.08A","3ai8A-4wcjA:undetectable","3ai8A-4wcjA:19.32"],["3AQI_A_CHDA2_0","FERROCHELATASE","4wcj","POLYSACCHARIDE DEACETYLASE","Ammonifex degensii",4,"MET A 162;ARG A 122;GLY A 145;TRP A 156","None; CL A 302 ( 4.8A);None;None","1.50A","3aqiA-4wcjA:undetectable","3aqiA-4wcjA:21.55"],["3M8P_A_65BA562_0","REVERSE TRANSCRIPTASE\/RIBONUCLEASE H;P51 RT","4wcj","POLYSACCHARIDE DEACETYLASE","Ammonifex degensii",5,"LEU A 242;VAL A  89;VAL A  40;TYR A  97;TYR A 219","None","1.33A","3m8pA-4wcjA:undetectable;3m8pB-4wcjA:1.6","3m8pA-4wcjA:18.49;3m8pB-4wcjA:21.40"],["3NS1_C_PM6C1_1","XANTHINE DEHYDROGENASE\/OXIDASE","4wcj","POLYSACCHARIDE DEACETYLASE","Ammonifex degensii",4,"ARG A 261;PHE A 244;THR A 112;ALA A 221","None","1.08A","3ns1C-4wcjA:undetectable","3ns1C-4wcjA:16.23"],["3U9F_B_CLMB221_0","CHLORAMPHENICOL ACETYLTRANSFERASE","4wcj","POLYSACCHARIDE DEACETYLASE","Ammonifex degensii",5,"THR A 265;SER A 268;LEU A  33;VAL A 250;VAL A 272","None","1.40A","3u9fB-4wcjA:undetectable;3u9fC-4wcjA:undetectable","3u9fB-4wcjA:18.52;3u9fC-4wcjA:18.52"],["3U9F_E_CLME221_0","CHLORAMPHENICOL ACETYLTRANSFERASE","4wcj","POLYSACCHARIDE DEACETYLASE","Ammonifex degensii",5,"THR A 265;SER A 268;LEU A  33;VAL A 250;VAL A 272","None","1.45A","3u9fE-4wcjA:undetectable","3u9fE-4wcjA:18.52"],["3U9F_I_CLMI221_1","CHLORAMPHENICOL ACETYLTRANSFERASE","4wcj","POLYSACCHARIDE DEACETYLASE","Ammonifex degensii",5,"THR A 265;SER A 268;LEU A  33;VAL A 250;VAL A 272","None","1.45A","3u9fI-4wcjA:undetectable","3u9fI-4wcjA:18.52"],["3U9F_K_CLMK221_0","CHLORAMPHENICOL ACETYLTRANSFERASE","4wcj","POLYSACCHARIDE DEACETYLASE","Ammonifex degensii",5,"THR A 265;SER A 268;LEU A  33;VAL A 250;VAL A 272","None","1.41A","3u9fK-4wcjA:undetectable","3u9fK-4wcjA:18.52"],["3U9F_P_CLMP221_0","CHLORAMPHENICOL ACETYLTRANSFERASE","4wcj","POLYSACCHARIDE DEACETYLASE","Ammonifex degensii",5,"THR A 265;SER A 268;LEU A  33;VAL A 250;VAL A 272","None","1.44A","3u9fP-4wcjA:undetectable","3u9fP-4wcjA:18.52"],["3U9F_S_CLMS221_0","CHLORAMPHENICOL ACETYLTRANSFERASE","4wcj","POLYSACCHARIDE DEACETYLASE","Ammonifex degensii",5,"THR A 265;SER A 268;LEU A  33;VAL A 250;VAL A 272","None","1.40A","3u9fP-4wcjA:undetectable;3u9fS-4wcjA:undetectable","3u9fP-4wcjA:18.52;3u9fS-4wcjA:18.52"],["4FGK_A_0TXA302_0","RIBOSYLDIHYDRONICOTINAMIDE DEHYDROGENASE [QUINONE]","4wcj","POLYSACCHARIDE DEACETYLASE","Ammonifex degensii",4,"ILE A 133;PRO A 134;PHE A 135;PHE A 113","None","0.95A","4fgkA-4wcjA:undetectable","4fgkA-4wcjA:23.08"],["4G1Q_A_T27A601_1","REVERSE TRANSCRIPTASE\/RIBONUCLEASE H","4wcj","POLYSACCHARIDE DEACETYLASE","Ammonifex degensii",5,"LEU A 242;VAL A  89;VAL A  40;TYR A  97;TYR A 219","None","1.31A","4g1qA-4wcjA:undetectable","4g1qA-4wcjA:18.89"],["4ICL_A_T27A601_1","REVERSE TRANSCRIPTASE\/RIBONUCLEASE H","4wcj","POLYSACCHARIDE DEACETYLASE","Ammonifex degensii",5,"LEU A 242;VAL A  89;VAL A  40;TYR A  97;TYR A 219","None","1.31A","4iclA-4wcjA:1.5","4iclA-4wcjA:18.89"],["4ID5_A_T27A601_1","REVERSE TRANSCRIPTASE\/RIBONUCLEASE H","4wcj","POLYSACCHARIDE DEACETYLASE","Ammonifex degensii",5,"LEU A 242;VAL A  89;VAL A  40;TYR A  97;TYR A 219","None","1.31A","4id5A-4wcjA:undetectable","4id5A-4wcjA:18.89"],["4IDK_A_T27A601_1","REVERSE TRANSCRIPTASE\/RIBONUCLEASE H","4wcj","POLYSACCHARIDE DEACETYLASE","Ammonifex degensii",5,"LEU A 242;VAL A  89;VAL A  40;TYR A  97;TYR A 219","None","1.31A","4idkA-4wcjA:0.3","4idkA-4wcjA:18.89"],["4IFV_A_T27A601_1","EXORIBONUCLEASE H, P66 RT","4wcj","POLYSACCHARIDE DEACETYLASE","Ammonifex degensii",5,"LEU A 242;VAL A  89;VAL A  40;TYR A  97;TYR A 219","None","1.29A","4ifvA-4wcjA:1.4","4ifvA-4wcjA:18.89"],["4IFY_A_T27A601_1","REVERSE TRANSCRIPTASE\/RIBONUCLEASE H","4wcj","POLYSACCHARIDE DEACETYLASE","Ammonifex degensii",5,"LEU A 242;VAL A  89;VAL A  40;TYR A  97;TYR A 219","None","1.31A","4ifyA-4wcjA:1.4","4ifyA-4wcjA:18.89"],["4IG3_A_T27A601_1","REVERSE TRANSCRIPTASE\/RIBONUCLEASE H","4wcj","POLYSACCHARIDE DEACETYLASE","Ammonifex degensii",5,"LEU A 242;VAL A  89;VAL A  40;TYR A  97;TYR A 219","None","1.33A","4ig3A-4wcjA:undetectable","4ig3A-4wcjA:18.89"],["4KFB_A_T27A607_1","REVERSE TRANSCRIPTASE\/RIBONUCLEASE H, EXORIBONUCLEA P66 RT","4wcj","POLYSACCHARIDE DEACETYLASE","Ammonifex degensii",5,"LEU A 242;VAL A  89;VAL A  40;TYR A  97;TYR A 219","None","1.34A","4kfbA-4wcjA:1.5","4kfbA-4wcjA:18.89"],["4LV9_A_20JA601_1","NICOTINAMIDE PHOSPHORIBOSYLTRANSFERASE;NICOTINAMIDE PHOSPHORIBOSYLTRANSFERASE","4wcj","POLYSACCHARIDE DEACETYLASE","Ammonifex degensii",4,"PHE A 151;ASP A 117;SER A 119;ALA A  68","None","1.10A","4lv9A-4wcjA:3.2;4lv9B-4wcjA:3.1","4lv9A-4wcjA:18.33;4lv9B-4wcjA:18.33"],["4LV9_B_20JB601_1","NICOTINAMIDE PHOSPHORIBOSYLTRANSFERASE;NICOTINAMIDE PHOSPHORIBOSYLTRANSFERASE","4wcj","POLYSACCHARIDE DEACETYLASE","Ammonifex degensii",4,"PHE A 151;ASP A 117;SER A 119;ALA A  68","None","1.12A","4lv9A-4wcjA:3.2;4lv9B-4wcjA:3.1","4lv9A-4wcjA:18.33;4lv9B-4wcjA:18.33"],["4PST_A_FOLA201_1","DIHYDROFOLATE REDUCTASE","4wcj","POLYSACCHARIDE DEACETYLASE","Ammonifex degensii",3,"ILE A 140;ASP A 201;ARG A 146","None","0.71A","4pstA-4wcjA:undetectable","4pstA-4wcjA:22.41"],["5CYM_A_T27A601_1","HIV-1 REVERSE TRANSCRIPTASE, P66 SUBUNIT","4wcj","POLYSACCHARIDE DEACETYLASE","Ammonifex degensii",5,"LEU A 242;VAL A  89;VAL A  40;TYR A  97;TYR A 219","None","1.33A","5cymA-4wcjA:1.5","5cymA-4wcjA:18.89"],["5CYQ_A_T27A601_1","HIV-1 REVERSE TRANSCRIPTASE, P66 SUBUNIT","4wcj","POLYSACCHARIDE DEACETYLASE","Ammonifex degensii",5,"LEU A 242;VAL A  89;VAL A  40;TYR A  97;TYR A 219","None","1.35A","5cyqA-4wcjA:1.5","5cyqA-4wcjA:18.89"],["5NCD_A_ACTA301_0","PEPTIDOGLYCAN N-ACETYLGLUCOSAMINE DEACETYLASE","4wcj","POLYSACCHARIDE DEACETYLASE","Ammonifex degensii",5,"ASP A 114;ASP A 115;HIS A 173;HIS A 178;HIS A  44"," ZN A 301 ( 4.8A); ZN A 301 (-2.7A); ZN A 301 (-3.3A); ZN A 301 (-3.3A);None","0.38A","5ncdA-4wcjA:10.0;5ncdD-4wcjA:4.6","5ncdA-4wcjA:21.07;5ncdD-4wcjA:21.07"],["5NCD_C_ACTC301_0","PEPTIDOGLYCAN N-ACETYLGLUCOSAMINE DEACETYLASE","4wcj","POLYSACCHARIDE DEACETYLASE","Ammonifex degensii",5,"ASP A 114;ASP A 115;HIS A 173;HIS A 178;HIS A  44"," ZN A 301 ( 4.8A); ZN A 301 (-2.7A); ZN A 301 (-3.3A); ZN A 301 (-3.3A);None","0.35A","5ncdB-4wcjA:10.1;5ncdC-4wcjA:10.1","5ncdB-4wcjA:21.07;5ncdC-4wcjA:21.07"],["5NCD_D_ACTD301_0","PEPTIDOGLYCAN N-ACETYLGLUCOSAMINE DEACETYLASE","4wcj","POLYSACCHARIDE DEACETYLASE","Ammonifex degensii",4,"ASP A 114;HIS A 173;HIS A 178;HIS A  44"," ZN A 301 ( 4.8A); ZN A 301 (-3.3A); ZN A 301 (-3.3A);None","0.28A","5ncdD-4wcjA:4.6","5ncdD-4wcjA:21.07"],["5NEK_B_AZMB302_1","PEPTIDOGLYCAN N-ACETYLGLUCOSAMINE DEACETYLASE","4wcj","POLYSACCHARIDE DEACETYLASE","Ammonifex degensii",6,"ASP A 114;ASP A 115;HIS A 173;HIS A 178;PRO A 223;HIS A  44"," ZN A 301 ( 4.8A); ZN A 301 (-2.7A); ZN A 301 (-3.3A); ZN A 301 (-3.3A);None;None","0.37A","5nekB-4wcjA:10.0","5nekB-4wcjA:13.58"],["5NEK_D_AZMD302_1","PEPTIDOGLYCAN N-ACETYLGLUCOSAMINE DEACETYLASE","4wcj","POLYSACCHARIDE DEACETYLASE","Ammonifex degensii",5,"ASP A 114;ASP A 115;HIS A 173;HIS A 178;HIS A  44"," ZN A 301 ( 4.8A); ZN A 301 (-2.7A); ZN A 301 (-3.3A); ZN A 301 (-3.3A);None","0.46A","5nekD-4wcjA:10.1","5nekD-4wcjA:13.58"],["5NEL_A_ACTA302_0","PEPTIDOGLYCAN N-ACETYLGLUCOSAMINE DEACETYLASE","4wcj","POLYSACCHARIDE DEACETYLASE","Ammonifex degensii",5,"ASP A 114;ASP A 115;HIS A 173;HIS A 178;HIS A  44"," ZN A 301 ( 4.8A); ZN A 301 (-2.7A); ZN A 301 (-3.3A); ZN A 301 (-3.3A);None","0.44A","5nelA-4wcjA:4.7;5nelD-4wcjA:4.1","5nelA-4wcjA:21.07;5nelD-4wcjA:21.07"],["5NEL_C_ACTC302_0","PEPTIDOGLYCAN N-ACETYLGLUCOSAMINE DEACETYLASE","4wcj","POLYSACCHARIDE DEACETYLASE","Ammonifex degensii",4,"ASP A 114;HIS A 173;HIS A 178;HIS A  44"," ZN A 301 ( 4.8A); ZN A 301 (-3.3A); ZN A 301 (-3.3A);None","0.30A","5nelB-4wcjA:9.9;5nelC-4wcjA:10.1","5nelB-4wcjA:21.07;5nelC-4wcjA:21.07"],["5OEX_B_CUB601_0","THIOCYANATE DEHYDROGENASE","4wcj","POLYSACCHARIDE DEACETYLASE","Ammonifex degensii",3,"HIS A  44;ASP A 115;HIS A 173","None; ZN A 301 (-2.7A); ZN A 301 (-3.3A)","0.70A","5oexB-4wcjA:undetectable","5oexB-4wcjA:21.06"],["5OEX_C_CUC601_0","THIOCYANATE DEHYDROGENASE","4wcj","POLYSACCHARIDE DEACETYLASE","Ammonifex degensii",3,"HIS A  44;ASP A 115;HIS A 173","None; ZN A 301 (-2.7A); ZN A 301 (-3.3A)","0.68A","5oexC-4wcjA:undetectable","5oexC-4wcjA:21.06"],["5OEX_D_CUD601_0","THIOCYANATE DEHYDROGENASE","4wcj","POLYSACCHARIDE DEACETYLASE","Ammonifex degensii",3,"HIS A  44;ASP A 115;HIS A 173","None; ZN A 301 (-2.7A); ZN A 301 (-3.3A)","0.68A","5oexD-4wcjA:undetectable","5oexD-4wcjA:21.06"],["5WHY_A_SAMA504_0","RADICAL SAM DOMAIN PROTEIN","4wcj","POLYSACCHARIDE DEACETYLASE","Ammonifex degensii",5,"TYR A  43;CYH A  42;THR A  31;SER A 268;VAL A 111","None","1.46A","5whyA-4wcjA:4.3","5whyA-4wcjA:17.94"],["6ELI_A_T27A701_1","REVERSE TRANSCRIPTASE","4wcj","POLYSACCHARIDE DEACETYLASE","Ammonifex degensii",5,"LEU A 242;VAL A  89;VAL A  40;TYR A  97;TYR A 219","None","1.31A","6eliA-4wcjA:undetectable","6eliA-4wcjA:15.42"]]