SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4nwz'

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 (%)		 View Dock
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.
1PWY_E_AC2E290_1
(PURINE NUCLEOSIDE
PHOSPHORYLASE)		 4nwz FAD-DEPENDENT
PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Caldalkalibacill
us
thermarum) 		5 / 10 GLY A 323
PHE A 342
VAL A 297
GLY A 298
VAL A 326
 None
None
None
FAD  A 601 (-3.0A)
None
 1.16A 1pwyE-4nwzA:
undetectable		 1pwyE-4nwzA:
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.
1R5L_A_VIVA301_0
(PROTEIN
(ALPHA-TOCOPHEROL
TRANSFER PROTEIN))		 4nwz FAD-DEPENDENT
PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Caldalkalibacill
us
thermarum) 		5 / 12 ILE A  16
ILE A 334
ILE A   6
VAL A 104
ILE A  74
 None
 1.12A 1r5lA-4nwzA:
undetectable		 1r5lA-4nwzA:
21.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1RG9_B_SAMB485_0
(S-ADENOSYLMETHIONINE
SYNTHETASE)		 4nwz FAD-DEPENDENT
PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Caldalkalibacill
us
thermarum) 		4 / 8 ALA A  18
ASP A  32
ILE A   6
ILE A 334
 None
 0.93A 1rg9A-4nwzA:
undetectable		 1rg9A-4nwzA:
20.23
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.
1V3Q_E_2DIE290_1
(PURINE NUCLEOSIDE
PHOSPHORYLASE)		 4nwz FAD-DEPENDENT
PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Caldalkalibacill
us
thermarum) 		5 / 10 GLY A 106
VAL A 297
GLY A 298
VAL A 104
HIS A  42
 None
None
FAD  A 601 (-3.0A)
None
None
 1.20A 1v3qE-4nwzA:
undetectable		 1v3qE-4nwzA:
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.
1V3Q_E_2DIE290_1
(PURINE NUCLEOSIDE
PHOSPHORYLASE)		 4nwz FAD-DEPENDENT
PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Caldalkalibacill
us
thermarum) 		5 / 10 GLY A 323
PHE A 342
VAL A 297
GLY A 298
VAL A 326
 None
None
None
FAD  A 601 (-3.0A)
None
 1.20A 1v3qE-4nwzA:
undetectable		 1v3qE-4nwzA:
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.
1YA4_A_CTXA1_1
(CES1 PROTEIN)		 4nwz FAD-DEPENDENT
PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Caldalkalibacill
us
thermarum) 		5 / 12 ALA A  18
GLY A 106
LEU A 103
LEU A  35
LEU A  98
 None
 0.88A 1ya4A-4nwzA:
undetectable		 1ya4A-4nwzA:
21.77
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.
1ZQ9_A_SAMA4000_1
(PROBABLE
DIMETHYLADENOSINE
TRANSFERASE)		 4nwz FAD-DEPENDENT
PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Caldalkalibacill
us
thermarum) 		3 / 3 GLY A 354
GLU A 173
ASN A 356
 None
 0.71A 1zq9A-4nwzA:
undetectable		 1zq9A-4nwzA:
21.98
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.
2F80_B_017B301_2
(POL POLYPROTEIN)		 4nwz FAD-DEPENDENT
PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Caldalkalibacill
us
thermarum) 		5 / 12 GLY A 172
ASN A 196
GLY A 220
VAL A 192
ILE A 194
 None
 0.93A 2f80B-4nwzA:
undetectable		 2f80B-4nwzA:
15.40
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.
2HS1_B_017B203_1
(HIV-1 PROTEASE)		 4nwz FAD-DEPENDENT
PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Caldalkalibacill
us
thermarum) 		4 / 7 GLU A 292
PRO A 284
ARG A 287
GLY A 290
 None
 1.24A 2hs1B-4nwzA:
undetectable		 2hs1B-4nwzA:
15.40
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.
2PYM_A_1UNA1001_1
(PROTEASE RETROPEPSIN)		 4nwz FAD-DEPENDENT
PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Caldalkalibacill
us
thermarum) 		5 / 12 GLY A 172
ASN A 196
GLY A 220
VAL A 192
ILE A 194
 None
 0.88A 2pymA-4nwzA:
undetectable		 2pymA-4nwzA:
14.39
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.
2PYN_A_1UNA1001_1
(PROTEASE RETROPEPSIN)		 4nwz FAD-DEPENDENT
PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Caldalkalibacill
us
thermarum) 		5 / 12 GLY A 172
ASN A 196
GLY A 220
VAL A 192
ILE A 194
 None
 0.87A 2pynA-4nwzA:
undetectable		 2pynA-4nwzA:
14.39
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.
2PYN_A_1UNA1001_2
(PROTEASE RETROPEPSIN)		 4nwz FAD-DEPENDENT
PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Caldalkalibacill
us
thermarum) 		5 / 12 GLY A 172
ASN A 196
GLY A 220
VAL A 192
ILE A 194
 None
 0.87A 2pynB-4nwzA:
undetectable		 2pynB-4nwzA:
14.39
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.
2QAK_A_1UNA1001_3
(PROTEASE RETROPEPSIN)		 4nwz FAD-DEPENDENT
PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Caldalkalibacill
us
thermarum) 		5 / 12 GLY A 172
ASN A 196
GLY A 220
VAL A 192
ILE A 194
 None
 0.88A 2qakB-4nwzA:
undetectable		 2qakB-4nwzA:
12.63
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.
3BJW_B_SVRB512_1
(PHOSPHOLIPASE A2)		 4nwz FAD-DEPENDENT
PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Caldalkalibacill
us
thermarum) 		4 / 5 VAL A 240
VAL A 241
THR A 157
ARG A 234
 None
 1.21A 3bjwA-4nwzA:
undetectable		 3bjwA-4nwzA:
14.03
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.
3BOG_C_DVAC47_0
(6.5 KDA GLYCINE-RICH
ANTIFREEZE PROTEIN)		 4nwz FAD-DEPENDENT
PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Caldalkalibacill
us
thermarum) 		4 / 4 GLY A  12
GLY A  10
GLY A 106
GLY A  15
 FAD  A 601 (-3.3A)
FAD  A 601 ( 3.7A)
None
None
 0.66A 3bogC-4nwzA:
undetectable		 3bogC-4nwzA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3KPB_A_SAMA1000_0
(UNCHARACTERIZED
PROTEIN MJ0100)		 4nwz FAD-DEPENDENT
PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Caldalkalibacill
us
thermarum) 		5 / 12 ASN A  27
ILE A 334
ILE A   6
ILE A  33
PRO A   4
 None
 1.20A 3kpbA-4nwzA:
undetectable		 3kpbA-4nwzA:
13.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3OZW_A_KKKA413_1
(FLAVOHEMOGLOBIN)		 4nwz FAD-DEPENDENT
PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Caldalkalibacill
us
thermarum) 		4 / 8 ILE A   6
GLN A  23
ALA A 327
LEU A 330
 None
 0.78A 3ozwA-4nwzA:
3.6		 3ozwA-4nwzA:
23.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3PRS_A_RITA1001_2
(ENDOTHIAPEPSIN)		 4nwz FAD-DEPENDENT
PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Caldalkalibacill
us
thermarum) 		5 / 12 GLY A 220
GLY A 172
ASP A 176
PHE A 226
ILE A 194
 None
 0.92A 3prsA-4nwzA:
undetectable		 3prsA-4nwzA:
23.73
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.
4C5N_C_PXLC300_1
(PHOSPHOMETHYLPYRIMID
INE KINASE)		 4nwz FAD-DEPENDENT
PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Caldalkalibacill
us
thermarum) 		4 / 8 GLY A 164
GLY A 162
VAL A 203
VAL A 171
 None
 0.73A 4c5nC-4nwzA:
2.3		 4c5nC-4nwzA:
22.43
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.
4EJG_C_NCTC501_1
(CYTOCHROME P450 2A13)		 4nwz FAD-DEPENDENT
PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Caldalkalibacill
us
thermarum) 		4 / 7 PHE A 295
ALA A 332
LEU A  26
LEU A  22
 None
 0.75A 4ejgC-4nwzA:
undetectable		 4ejgC-4nwzA:
23.27
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.
4IV0_A_SAMA302_0
(PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE,
PUTATIVE)		 4nwz FAD-DEPENDENT
PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Caldalkalibacill
us
thermarum) 		5 / 12 VAL A  63
TYR A 383
ILE A 320
ILE A  69
HIS A  42
 None
 0.88A 4iv0A-4nwzA:
3.7		 4iv0A-4nwzA:
20.00
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.
4MWZ_A_SAMA301_0
(PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE,
PUTATIVE)		 4nwz FAD-DEPENDENT
PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Caldalkalibacill
us
thermarum) 		5 / 12 ILE A 296
GLY A  14
GLY A 298
ILE A  16
LEU A  35
 None
FAD  A 601 (-4.2A)
FAD  A 601 (-3.0A)
None
None
 1.10A 4mwzA-4nwzA:
3.8		 4mwzA-4nwzA:
19.43
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.
4MWZ_B_SAMB301_0
(PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE,
PUTATIVE)		 4nwz FAD-DEPENDENT
PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Caldalkalibacill
us
thermarum) 		5 / 12 VAL A  63
TYR A 383
ILE A 320
ILE A  69
HIS A  42
 None
 0.91A 4mwzB-4nwzA:
3.7		 4mwzB-4nwzA:
19.43
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.
4NDN_A_SAMA407_1
(S-ADENOSYLMETHIONINE
SYNTHASE ISOFORM
TYPE-2)		 4nwz FAD-DEPENDENT
PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Caldalkalibacill
us
thermarum) 		4 / 8 ALA A  18
ASP A  32
ILE A   6
ILE A 334
 None
 0.89A 4ndnB-4nwzA:
undetectable		 4ndnB-4nwzA:
23.14
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.
4NDN_C_SAMC405_1
(S-ADENOSYLMETHIONINE
SYNTHASE ISOFORM
TYPE-2)		 4nwz FAD-DEPENDENT
PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Caldalkalibacill
us
thermarum) 		4 / 8 ALA A  18
ASP A  32
ILE A   6
ILE A 334
 None
 0.85A 4ndnD-4nwzA:
undetectable		 4ndnD-4nwzA:
23.14
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.
4TWD_J_377J401_1
(CYS-LOOP
LIGAND-GATED ION
CHANNEL)		 4nwz FAD-DEPENDENT
PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Caldalkalibacill
us
thermarum) 		4 / 6 TYR A 141
GLU A 149
TYR A 155
LEU A 156
 None
 1.31A 4twdI-4nwzA:
undetectable
4twdJ-4nwzA:
undetectable		 4twdI-4nwzA:
23.37
4twdJ-4nwzA:
23.37
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.
4TXN_A_URFA302_1
(URIDINE
PHOSPHORYLASE)		 4nwz FAD-DEPENDENT
PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Caldalkalibacill
us
thermarum) 		4 / 7 GLY A  54
MET A 178
ALA A  52
ILE A 135
 None
 0.87A 4txnA-4nwzA:
undetectable		 4txnA-4nwzA:
21.83
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.
4TXN_B_URFB302_1
(URIDINE
PHOSPHORYLASE)		 4nwz FAD-DEPENDENT
PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Caldalkalibacill
us
thermarum) 		4 / 7 GLY A  54
MET A 178
ALA A  52
ILE A 135
 None
 0.87A 4txnB-4nwzA:
2.3		 4txnB-4nwzA:
21.83
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.
4TXN_C_URFC302_1
(URIDINE
PHOSPHORYLASE)		 4nwz FAD-DEPENDENT
PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Caldalkalibacill
us
thermarum) 		4 / 7 GLY A  54
MET A 178
ALA A  52
ILE A 135
 None
 0.90A 4txnC-4nwzA:
undetectable		 4txnC-4nwzA:
21.83
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.
4TXN_D_URFD302_1
(URIDINE
PHOSPHORYLASE)		 4nwz FAD-DEPENDENT
PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Caldalkalibacill
us
thermarum) 		4 / 7 GLY A  54
MET A 178
ALA A  52
ILE A 135
 None
 0.85A 4txnD-4nwzA:
undetectable		 4txnD-4nwzA:
21.83
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.
4YVG_A_SAMA301_0
(TRNA
(GUANINE-N(1)-)-METH
YLTRANSFERASE)		 4nwz FAD-DEPENDENT
PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Caldalkalibacill
us
thermarum) 		5 / 12 GLY A  14
GLU A 324
GLY A 323
ILE A  65
GLY A  12
 FAD  A 601 (-4.2A)
None
None
None
FAD  A 601 (-3.3A)
 1.01A 4yvgA-4nwzA:
undetectable		 4yvgA-4nwzA:
19.57
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.
5ALB_L_TIQL1210_2
(MEDI2452 LIGHT CHAIN)		 4nwz FAD-DEPENDENT
PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Caldalkalibacill
us
thermarum) 		4 / 8 GLY A  21
TYR A  13
ALA A 319
GLY A 323
 None
FAD  A 601 (-4.5A)
FAD  A 601 ( 4.0A)
None
 0.90A 5albL-4nwzA:
undetectable		 5albL-4nwzA:
18.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5D75_A_FK5A301_1
(PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
FKBP3)		 4nwz FAD-DEPENDENT
PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Caldalkalibacill
us
thermarum) 		5 / 11 LEU A  35
ILE A 387
TYR A 383
ALA A 319
ILE A 320
 None
None
None
FAD  A 601 ( 4.0A)
None
 0.99A 5d75A-4nwzA:
undetectable		 5d75A-4nwzA:
15.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5GPG_A_RAPA301_1
(PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
FKBP3)		 4nwz FAD-DEPENDENT
PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Caldalkalibacill
us
thermarum) 		5 / 11 LEU A  35
ILE A 387
TYR A 383
ALA A 319
ILE A 320
 None
None
None
FAD  A 601 ( 4.0A)
None
 0.95A 5gpgA-4nwzA:
undetectable		 5gpgA-4nwzA:
14.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5IGV_A_ZITA404_1
(MACROLIDE
2'-PHOSPHOTRANSFERAS
E II)		 4nwz FAD-DEPENDENT
PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Caldalkalibacill
us
thermarum) 		5 / 12 ILE A 387
TYR A 383
HIS A  42
ALA A 316
ILE A   8
 None
None
None
FAD  A 601 (-3.6A)
None
 1.18A 5igvA-4nwzA:
undetectable		 5igvA-4nwzA:
23.57
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.
5IWU_A_ERYA404_0
(MACROLIDE
2'-PHOSPHOTRANSFERAS
E II)		 4nwz FAD-DEPENDENT
PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Caldalkalibacill
us
thermarum) 		5 / 12 ILE A 387
TYR A 383
HIS A  42
ALA A 316
ILE A   8
 None
None
None
FAD  A 601 (-3.6A)
None
 1.26A 5iwuA-4nwzA:
undetectable		 5iwuA-4nwzA:
23.57
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.
5OG9_A_TESA504_1
(-)		 4nwz FAD-DEPENDENT
PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Caldalkalibacill
us
thermarum) 		4 / 8 ILE A  65
ILE A  33
ALA A  18
LEU A  20
 None
 0.78A 5og9A-4nwzA:
undetectable		 5og9A-4nwzA:
21.36
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.
5T8H_B_478B401_2
(PROTEASE)		 4nwz FAD-DEPENDENT
PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Caldalkalibacill
us
thermarum) 		5 / 12 LEU A  68
GLY A  12
ALA A  11
ILE A 129
ILE A  65
 None
FAD  A 601 (-3.3A)
FAD  A 601 (-4.7A)
None
None
 0.86A 5t8hB-4nwzA:
undetectable		 5t8hB-4nwzA:
15.15
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.
5T8S_B_SAMB402_0
(S-ADENOSYLMETHIONINE
SYNTHASE)		 4nwz FAD-DEPENDENT
PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Caldalkalibacill
us
thermarum) 		4 / 8 ALA A  18
ASP A  32
ILE A   6
ILE A 334
 None
 0.94A 5t8sA-4nwzA:
undetectable		 5t8sA-4nwzA:
24.77
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.
5X7F_A_SAMA301_0
(PUTATIVE
O-METHYLTRANSFERASE
RV1220C)		 4nwz FAD-DEPENDENT
PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Caldalkalibacill
us
thermarum) 		5 / 12 GLY A 264
VAL A 262
GLY A 298
GLY A 108
ALA A 301
 None
None
FAD  A 601 (-3.0A)
FAD  A 601 (-3.3A)
None
 1.03A 5x7fA-4nwzA:
3.5		 5x7fA-4nwzA:
21.03
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.
6FBN_B_SAMB401_0
(S-ADENOSYLMETHIONINE
SYNTHASE ISOFORM
TYPE-2)		 4nwz FAD-DEPENDENT
PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Caldalkalibacill
us
thermarum) 		4 / 7 ALA A  18
ASP A  32
ILE A   6
ILE A 334
 None
 0.86A 6fbnA-4nwzA:
undetectable		 6fbnA-4nwzA:
23.35