SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4be9'

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.
1AFS_A_TESA325_1
(3-ALPHA-HYDROXYSTERO
ID DEHYDROGENASE)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		4 / 7 LEU A 149
THR A 215
ASN A 251
TYR A 489
 None
 1.30A 1afsA-4be9A:
undetectable		 1afsA-4be9A:
19.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1AFS_B_TESB325_1
(3-ALPHA-HYDROXYSTERO
ID DEHYDROGENASE)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		4 / 7 LEU A 149
THR A 215
ASN A 251
TYR A 489
 None
 1.30A 1afsB-4be9A:
undetectable		 1afsB-4be9A:
19.75
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1AX9_A_EDRA999_1
(ACETYLCHOLINESTERASE)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		5 / 8 GLY A 134
GLU A 219
SER A 220
PHE A 356
HIS A 465
 PGE  A1554 ( 4.7A)
None
1PE  A1553 (-2.9A)
None
None
 0.69A 1ax9A-4be9A:
43.6		 1ax9A-4be9A:
32.62
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1AX9_A_EDRA999_1
(ACETYLCHOLINESTERASE)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		5 / 8 GLY A 135
GLU A 219
SER A 220
PHE A 356
HIS A 465
 1PE  A1553 (-3.3A)
None
1PE  A1553 (-2.9A)
None
None
 0.87A 1ax9A-4be9A:
43.6		 1ax9A-4be9A:
32.62
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DX6_A_GNTA602_1
(ACETYLCHOLINESTERASE)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		6 / 12 GLY A 133
GLY A 134
GLY A 135
SER A 220
PHE A 356
HIS A 465
 None
PGE  A1554 ( 4.7A)
1PE  A1553 (-3.3A)
1PE  A1553 (-2.9A)
None
None
 0.31A 1dx6A-4be9A:
42.2		 1dx6A-4be9A:
32.46
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.
1E06_B_IPBB600_0
(ODORANT-BINDING
PROTEIN)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		4 / 4 ILE A 216
MET A 250
VAL A 334
GLY A 247
 None
 1.17A 1e06B-4be9A:
undetectable		 1e06B-4be9A:
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.
1GXS_A_BEZA601_0
(P-(S)-HYDROXYMANDELO
NITRILE LYASE CHAIN
A
P-(S)-HYDROXYMANDELO
NITRILE LYASE CHAIN
B)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		4 / 7 GLY A 253
ASP A 468
SER A 223
ALA A 466
 None
None
None
PGE  A1554 ( 4.6A)
 0.93A 1gxsA-4be9A:
8.3
1gxsB-4be9A:
0.7		 1gxsA-4be9A:
18.94
1gxsB-4be9A:
17.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1MAA_C_DMEC997_1
(ACETYLCHOLINESTERASE)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		5 / 12 GLY A 134
TYR A 144
SER A 220
PHE A 356
HIS A 465
 PGE  A1554 ( 4.7A)
None
1PE  A1553 (-2.9A)
None
None
 0.42A 1maaC-4be9A:
40.4		 1maaC-4be9A:
31.18
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1MAA_D_DMED999_1
(ACETYLCHOLINESTERASE)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		4 / 8 GLY A 134
GLU A 219
SER A 220
HIS A 465
 PGE  A1554 ( 4.7A)
None
1PE  A1553 (-2.9A)
None
 0.39A 1maaD-4be9A:
37.0		 1maaD-4be9A:
31.18
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1MAA_D_DMED999_1
(ACETYLCHOLINESTERASE)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		4 / 8 GLY A 135
GLU A 219
SER A 220
HIS A 465
 1PE  A1553 (-3.3A)
None
1PE  A1553 (-2.9A)
None
 0.75A 1maaD-4be9A:
37.0		 1maaD-4be9A:
31.18
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1MX1_A_THAA1_1
(LIVER
CARBOXYLESTERASE I)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		5 / 11 GLY A 135
SER A 220
VAL A 256
LEU A 315
HIS A 465
 1PE  A1553 (-3.3A)
1PE  A1553 (-2.9A)
1PE  A1553 ( 4.4A)
1PE  A1553 (-4.3A)
None
 0.94A 1mx1A-4be9A:
41.2		 1mx1A-4be9A:
31.91
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1MX1_D_THAD4_1
(LIVER
CARBOXYLESTERASE I)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		5 / 12 GLY A 134
GLY A 135
SER A 220
PHE A 427
HIS A 465
 PGE  A1554 ( 4.7A)
1PE  A1553 (-3.3A)
1PE  A1553 (-2.9A)
1PE  A1553 (-4.7A)
None
 0.51A 1mx1D-4be9A:
41.3		 1mx1D-4be9A:
31.91
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1MX1_F_THAF6_1
(LIVER
CARBOXYLESTERASE I)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		5 / 12 GLY A 133
GLY A 134
LEU A 138
PHE A 356
HIS A 465
 None
PGE  A1554 ( 4.7A)
None
None
None
 0.78A 1mx1F-4be9A:
40.8		 1mx1F-4be9A:
31.91
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1MX1_F_THAF6_1
(LIVER
CARBOXYLESTERASE I)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		6 / 12 GLY A 134
GLY A 135
SER A 220
LEU A 315
PHE A 427
HIS A 465
 PGE  A1554 ( 4.7A)
1PE  A1553 (-3.3A)
1PE  A1553 (-2.9A)
1PE  A1553 (-4.3A)
1PE  A1553 (-4.7A)
None
 0.67A 1mx1F-4be9A:
40.8		 1mx1F-4be9A:
31.91
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1QTI_A_GNTA600_1
(ACETYLCHOLINESTERASE)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		7 / 12 GLY A 133
GLY A 134
GLY A 135
GLU A 219
SER A 220
PHE A 356
HIS A 465
 None
PGE  A1554 ( 4.7A)
1PE  A1553 (-3.3A)
None
1PE  A1553 (-2.9A)
None
None
 0.43A 1qtiA-4be9A:
43.6		 1qtiA-4be9A:
32.62
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1QTI_A_GNTA600_1
(ACETYLCHOLINESTERASE)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		7 / 12 GLY A 133
GLY A 134
GLY A 135
GLU A 219
SER A 220
PHE A 356
HIS A 465
 None
PGE  A1554 ( 4.7A)
1PE  A1553 (-3.3A)
None
1PE  A1553 (-2.9A)
None
None
 0.81A 1qtiA-4be9A:
43.6		 1qtiA-4be9A:
32.62
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1QTI_A_GNTA600_1
(ACETYLCHOLINESTERASE)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		5 / 12 GLY A 135
GLU A 219
SER A 220
PHE A 356
HIS A 465
 1PE  A1553 (-3.3A)
None
1PE  A1553 (-2.9A)
None
None
 0.78A 1qtiA-4be9A:
43.6		 1qtiA-4be9A:
32.62
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1W6R_A_GNTA1536_1
(ACETYLCHOLINESTERASE)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		6 / 12 GLY A 133
GLY A 134
GLY A 135
SER A 220
PHE A 356
HIS A 465
 None
PGE  A1554 ( 4.7A)
1PE  A1553 (-3.3A)
1PE  A1553 (-2.9A)
None
None
 0.35A 1w6rA-4be9A:
42.2		 1w6rA-4be9A:
32.46
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1W6R_A_GNTA1536_1
(ACETYLCHOLINESTERASE)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		6 / 12 GLY A 133
GLY A 134
GLY A 135
SER A 220
PHE A 356
HIS A 465
 None
PGE  A1554 ( 4.7A)
1PE  A1553 (-3.3A)
1PE  A1553 (-2.9A)
None
None
 0.86A 1w6rA-4be9A:
42.2		 1w6rA-4be9A:
32.46
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1W76_A_GNTA1538_1
(ACETYLCHOLINESTERASE)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		6 / 11 GLY A 134
GLY A 135
GLU A 219
SER A 220
PHE A 356
HIS A 465
 PGE  A1554 ( 4.7A)
1PE  A1553 (-3.3A)
None
1PE  A1553 (-2.9A)
None
None
 0.36A 1w76A-4be9A:
43.7		 1w76A-4be9A:
32.46
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1W76_B_GNTB1538_1
(ACETYLCHOLINESTERASE)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		6 / 10 GLY A 133
GLY A 134
GLU A 219
SER A 220
PHE A 356
HIS A 465
 None
PGE  A1554 ( 4.7A)
None
1PE  A1553 (-2.9A)
None
None
 0.33A 1w76B-4be9A:
43.7		 1w76B-4be9A:
32.46
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1W76_B_GNTB1538_1
(ACETYLCHOLINESTERASE)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		5 / 10 GLY A 134
GLY A 135
SER A 220
PHE A 356
HIS A 465
 PGE  A1554 ( 4.7A)
1PE  A1553 (-3.3A)
1PE  A1553 (-2.9A)
None
None
 1.04A 1w76B-4be9A:
43.7		 1w76B-4be9A:
32.46
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1W76_B_GNTB1538_1
(ACETYLCHOLINESTERASE)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		5 / 10 GLY A 135
GLU A 219
SER A 220
PHE A 356
HIS A 465
 1PE  A1553 (-3.3A)
None
1PE  A1553 (-2.9A)
None
None
 0.80A 1w76B-4be9A:
43.7		 1w76B-4be9A:
32.46
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1YA4_A_CTXA1_1
(CES1 PROTEIN)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		5 / 12 GLY A 134
GLY A 135
SER A 220
SER A 309
HIS A 465
 PGE  A1554 ( 4.7A)
1PE  A1553 (-3.3A)
1PE  A1553 (-2.9A)
None
None
 1.03A 1ya4A-4be9A:
41.2		 1ya4A-4be9A:
32.34
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1YA4_A_CTXA1_1
(CES1 PROTEIN)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		5 / 12 GLY A 134
GLY A 135
SER A 220
SER A 311
HIS A 465
 PGE  A1554 ( 4.7A)
1PE  A1553 (-3.3A)
1PE  A1553 (-2.9A)
None
None
 1.00A 1ya4A-4be9A:
41.2		 1ya4A-4be9A:
32.34
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1YA4_B_CTXB2_1
(CES1 PROTEIN)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		5 / 12 GLY A 134
GLY A 135
SER A 220
LEU A 355
HIS A 465
 PGE  A1554 ( 4.7A)
1PE  A1553 (-3.3A)
1PE  A1553 (-2.9A)
PEG  A1555 (-4.6A)
None
 0.66A 1ya4B-4be9A:
37.0		 1ya4B-4be9A:
32.34
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1YA4_B_CTXB2_1
(CES1 PROTEIN)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		5 / 12 GLY A 134
GLY A 135
SER A 220
SER A 309
HIS A 465
 PGE  A1554 ( 4.7A)
1PE  A1553 (-3.3A)
1PE  A1553 (-2.9A)
None
None
 1.01A 1ya4B-4be9A:
37.0		 1ya4B-4be9A:
32.34
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1YA4_B_CTXB2_1
(CES1 PROTEIN)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		5 / 12 GLY A 135
SER A 220
SER A 311
LEU A 355
HIS A 465
 1PE  A1553 (-3.3A)
1PE  A1553 (-2.9A)
None
PEG  A1555 (-4.6A)
None
 0.81A 1ya4B-4be9A:
37.0		 1ya4B-4be9A:
32.34
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1YA4_C_CTXC3_1
(CES1 PROTEIN)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		5 / 12 GLY A 133
LEU A 138
LEU A 355
LEU A 315
HIS A 465
 None
None
PEG  A1555 (-4.6A)
1PE  A1553 (-4.3A)
None
 1.02A 1ya4C-4be9A:
41.1		 1ya4C-4be9A:
32.34
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1YA4_C_CTXC3_1
(CES1 PROTEIN)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		5 / 12 GLY A 134
GLY A 135
SER A 220
LEU A 355
HIS A 465
 PGE  A1554 ( 4.7A)
1PE  A1553 (-3.3A)
1PE  A1553 (-2.9A)
PEG  A1555 (-4.6A)
None
 0.66A 1ya4C-4be9A:
41.1		 1ya4C-4be9A:
32.34
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1YA4_C_CTXC3_1
(CES1 PROTEIN)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		5 / 12 GLY A 135
SER A 220
SER A 311
LEU A 355
HIS A 465
 1PE  A1553 (-3.3A)
1PE  A1553 (-2.9A)
None
PEG  A1555 (-4.6A)
None
 0.93A 1ya4C-4be9A:
41.1		 1ya4C-4be9A:
32.34
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1YAJ_F_BEZF5023_0
(CES1 PROTEIN)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		4 / 6 GLY A 133
SER A 220
LEU A 138
HIS A 465
 None
1PE  A1553 (-2.9A)
None
None
 0.85A 1yajF-4be9A:
40.3		 1yajF-4be9A:
32.34
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2ACE_A_ACHA998_0
(ACETYLCHOLINESTERASE)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		5 / 9 GLY A 133
GLY A 134
SER A 220
ALA A 221
HIS A 465
 None
PGE  A1554 ( 4.7A)
1PE  A1553 (-2.9A)
1PE  A1553 (-3.5A)
None
 0.87A 2aceA-4be9A:
42.4		 2aceA-4be9A:
32.62
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2ACE_A_ACHA998_0
(ACETYLCHOLINESTERASE)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		6 / 9 GLY A 134
GLY A 135
SER A 220
ALA A 221
PHE A 356
HIS A 465
 PGE  A1554 ( 4.7A)
1PE  A1553 (-3.3A)
1PE  A1553 (-2.9A)
1PE  A1553 (-3.5A)
None
None
 0.92A 2aceA-4be9A:
42.4		 2aceA-4be9A:
32.62
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2ACK_A_EDRA999_1
(ACETYLCHOLINESTERASE)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		5 / 7 GLY A 134
GLU A 219
SER A 220
PHE A 356
HIS A 465
 PGE  A1554 ( 4.7A)
None
1PE  A1553 (-2.9A)
None
None
 0.72A 2ackA-4be9A:
42.7		 2ackA-4be9A:
32.62
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2ACK_A_EDRA999_1
(ACETYLCHOLINESTERASE)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		4 / 7 GLY A 135
SER A 220
PHE A 356
HIS A 465
 1PE  A1553 (-3.3A)
1PE  A1553 (-2.9A)
None
None
 0.84A 2ackA-4be9A:
42.7		 2ackA-4be9A:
32.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2DM6_A_IMNA1401_1
(NADP-DEPENDENT
LEUKOTRIENE B4
12-HYDROXYDEHYDROGEN
ASE)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		5 / 10 TYR A 521
ILE A 520
TYR A 480
ILE A 527
ILE A 506
 None
 1.28A 2dm6A-4be9A:
undetectable
2dm6B-4be9A:
undetectable		 2dm6A-4be9A:
22.35
2dm6B-4be9A:
22.35
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.
2EGV_A_SAMA1300_0
(UPF0088 PROTEIN
AQ_165)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		5 / 12 LEU A 111
ASN A 141
VAL A  38
GLY A  37
GLY A  69
 None
None
None
NO3  A1557 ( 4.1A)
NO3  A1557 ( 4.0A)
 0.87A 2egvA-4be9A:
undetectable		 2egvA-4be9A:
19.47
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.
2EGV_B_SAMB1400_0
(UPF0088 PROTEIN
AQ_165)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		5 / 12 LEU A 111
ASN A 141
VAL A  38
GLY A  37
GLY A  69
 None
None
None
NO3  A1557 ( 4.1A)
NO3  A1557 ( 4.0A)
 0.87A 2egvB-4be9A:
undetectable		 2egvB-4be9A:
19.47
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.
2G72_B_SAMB2002_1
(PHENYLETHANOLAMINE
N-METHYLTRANSFERASE)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		4 / 7 TYR A 144
TYR A 143
ASP A 468
ASP A 348
 None
PEG  A1559 ( 4.7A)
None
None
 1.09A 2g72B-4be9A:
undetectable		 2g72B-4be9A:
18.03
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2HA4_A_ACHA546_0
(ACETYLCHOLINESTERASE)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		4 / 8 TYR A 144
GLU A 219
PHE A 356
HIS A 465
 None
 0.34A 2ha4A-4be9A:
40.3		 2ha4A-4be9A:
30.94
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2HA4_A_ACTA544_0
(ACETYLCHOLINESTERASE)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		5 / 8 GLY A 134
GLY A 135
ALA A 221
PHE A 356
HIS A 465
 PGE  A1554 ( 4.7A)
1PE  A1553 (-3.3A)
1PE  A1553 (-3.5A)
None
None
 1.02A 2ha4A-4be9A:
40.3		 2ha4A-4be9A:
30.94
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2HA4_B_ACTB601_0
(ACETYLCHOLINESTERASE)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		4 / 7 GLY A 134
GLY A 135
ALA A 221
HIS A 465
 PGE  A1554 ( 4.7A)
1PE  A1553 (-3.3A)
1PE  A1553 (-3.5A)
None
 0.25A 2ha4B-4be9A:
41.5		 2ha4B-4be9A:
30.94
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.
3AQI_B_CHDB5_0
(FERROCHELATASE)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		3 / 3 PRO A  52
LEU A 191
ARG A 194
 None
 0.73A 3aqiB-4be9A:
2.6		 3aqiB-4be9A:
20.87
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.
3ELZ_A_CHDA151_0
(ILEAL BILE
ACID-BINDING PROTEIN)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		4 / 7 ILE A 113
GLY A 208
VAL A  15
LEU A 150
 None
 0.78A 3elzA-4be9A:
undetectable		 3elzA-4be9A:
13.21
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.
3GAN_A_SVRA158_1
(UNCHARACTERIZED
PROTEIN AT3G22680)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		5 / 11 PRO A 343
PRO A 498
TYR A 454
ILE A 485
ILE A 490
 None
 1.36A 3ganA-4be9A:
undetectable		 3ganA-4be9A:
15.16
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3O9M_A_BEZA999_0
(CHOLINESTERASE)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		5 / 7 GLY A 134
GLY A 135
SER A 220
PHE A 427
HIS A 465
 PGE  A1554 ( 4.7A)
1PE  A1553 (-3.3A)
1PE  A1553 (-2.9A)
1PE  A1553 (-4.7A)
None
 0.52A 3o9mA-4be9A:
42.6		 3o9mA-4be9A:
31.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3O9M_B_BEZB999_0
(CHOLINESTERASE)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		4 / 6 GLY A 134
GLY A 135
SER A 220
HIS A 465
 PGE  A1554 ( 4.7A)
1PE  A1553 (-3.3A)
1PE  A1553 (-2.9A)
None
 0.47A 3o9mB-4be9A:
42.6		 3o9mB-4be9A:
31.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3OU6_B_SAMB300_1
(SAM-DEPENDENT
METHYLTRANSFERASE)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		3 / 3 TYR A 144
ASP A 468
ASP A 348
 None
 0.73A 3ou6B-4be9A:
undetectable		 3ou6B-4be9A:
17.55
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.
3TVX_B_PNXB902_1
(CAMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE 4A)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		4 / 7 TYR A 489
ASN A 251
ILE A 249
PHE A 492
 None
 1.26A 3tvxB-4be9A:
undetectable		 3tvxB-4be9A:
20.80
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.
3V4T_A_ACTA502_0
(UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		4 / 5 VAL A  27
SER A  34
GLY A  67
ARG A  36
 None
None
NO3  A1557 (-3.2A)
None
 1.39A 3v4tA-4be9A:
undetectable
3v4tD-4be9A:
undetectable		 3v4tA-4be9A:
22.69
3v4tD-4be9A:
22.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4EJ1_B_FOLB201_0
(DIHYDROFOLATE
REDUCTASE)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		5 / 12 ILE A 224
GLU A 331
ILE A 333
LEU A 326
THR A 426
 None
None
None
None
1PE  A1553 (-3.7A)
 1.07A 4ej1B-4be9A:
undetectable		 4ej1B-4be9A:
13.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4EY6_A_GNTA604_1
(ACETYLCHOLINESTERASE)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		6 / 12 GLY A 133
GLY A 134
GLY A 135
SER A 220
PHE A 356
HIS A 465
 None
PGE  A1554 ( 4.7A)
1PE  A1553 (-3.3A)
1PE  A1553 (-2.9A)
None
None
 0.25A 4ey6A-4be9A:
41.0		 4ey6A-4be9A:
31.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4EY6_A_GNTA604_1
(ACETYLCHOLINESTERASE)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		6 / 12 GLY A 133
GLY A 134
GLY A 135
SER A 220
PHE A 356
HIS A 465
 None
PGE  A1554 ( 4.7A)
1PE  A1553 (-3.3A)
1PE  A1553 (-2.9A)
None
None
 0.94A 4ey6A-4be9A:
41.0		 4ey6A-4be9A:
31.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4EY6_B_GNTB605_1
(ACETYLCHOLINESTERASE)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		7 / 12 GLY A 133
GLY A 134
GLY A 135
GLU A 219
SER A 220
PHE A 356
HIS A 465
 None
PGE  A1554 ( 4.7A)
1PE  A1553 (-3.3A)
None
1PE  A1553 (-2.9A)
None
None
 0.28A 4ey6B-4be9A:
37.3		 4ey6B-4be9A:
31.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4EY6_B_GNTB605_1
(ACETYLCHOLINESTERASE)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		7 / 12 GLY A 133
GLY A 134
GLY A 135
GLU A 219
SER A 220
PHE A 356
HIS A 465
 None
PGE  A1554 ( 4.7A)
1PE  A1553 (-3.3A)
None
1PE  A1553 (-2.9A)
None
None
 0.91A 4ey6B-4be9A:
37.3		 4ey6B-4be9A:
31.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4JX1_E_CAME502_0
(CAMPHOR
5-MONOOXYGENASE)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		4 / 5 PHE A 207
TYR A  19
THR A 110
ILE A 113
 None
 1.15A 4jx1E-4be9A:
undetectable		 4jx1E-4be9A:
20.59
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.
4QOI_B_ML1B303_1
(RIBOSYLDIHYDRONICOTI
NAMIDE DEHYDROGENASE
[QUINONE])		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		5 / 11 GLY A 134
GLY A 135
GLY A 218
ILE A 224
PHE A 427
 PGE  A1554 ( 4.7A)
1PE  A1553 (-3.3A)
None
None
1PE  A1553 (-4.7A)
 1.15A 4qoiA-4be9A:
undetectable
4qoiB-4be9A:
2.2		 4qoiA-4be9A:
16.76
4qoiB-4be9A:
16.76
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.
4QZT_C_RTLC201_0
(RETINOL-BINDING
PROTEIN 2)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		5 / 12 PHE A 245
ALA A 340
TYR A 233
LEU A 232
LEU A 197
 None
 1.49A 4qztC-4be9A:
undetectable		 4qztC-4be9A:
13.66
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.
4XP3_A_DX4A401_0
(MITOGEN-ACTIVATED
PROTEIN KINASE 1)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		4 / 6 ALA A  41
GLN A  42
LEU A 109
LEU A  48
 None
 0.95A 4xp3A-4be9A:
undetectable		 4xp3A-4be9A:
20.66
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.
4ZE2_A_1YNA602_1
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		5 / 12 GLY A 501
LEU A 149
ILE A 469
GLY A 218
THR A 494
 None
None
PGE  A1554 ( 4.7A)
None
None
 1.16A 4ze2A-4be9A:
undetectable		 4ze2A-4be9A:
22.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ALC_L_TIQL1210_2
(ANTI-TICAGRELOR FAB
72, LIGHT CHAIN)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		4 / 8 SER A 225
GLY A 222
ILE A 313
GLY A 134
 None
None
1PE  A1553 (-4.7A)
PGE  A1554 ( 4.7A)
 0.86A 5alcL-4be9A:
undetectable		 5alcL-4be9A:
18.95
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.
5CDN_G_EVPG2101_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT
B,DNA GYRASE SUBUNIT
B)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		4 / 6 SER A 105
GLU A 106
GLY A  67
GLY A  37
 None
None
NO3  A1557 (-3.2A)
NO3  A1557 ( 4.1A)
 0.83A 5cdnA-4be9A:
undetectable
5cdnB-4be9A:
3.1		 5cdnA-4be9A:
22.07
5cdnB-4be9A:
15.06
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.
5DZK_3_BEZ3801_0
(ATP-DEPENDENT CLP
PROTEASE PROTEOLYTIC
SUBUNIT 1
BEZ-LEU-LEU)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		4 / 4 LEU A 451
ILE A 520
GLY A 347
ILE A 485
 GOL  A1556 (-4.9A)
None
None
None
 0.83A 5dzk3-4be9A:
undetectable
5dzkm-4be9A:
undetectable		 5dzk3-4be9A:
2.47
5dzkm-4be9A:
17.89
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.
5ESK_A_1YNA701_1
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		5 / 12 GLY A 501
LEU A 149
ILE A 469
GLY A 218
THR A 494
 None
None
PGE  A1554 ( 4.7A)
None
None
 1.18A 5eskA-4be9A:
undetectable		 5eskA-4be9A:
22.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5L0Z_A_SAMA304_0
(PROBABLE RNA
METHYLTRANSFERASE,
TRMH FAMILY)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		5 / 12 THR A 426
GLY A 253
ILE A 549
ASP A 228
LEU A 318
 1PE  A1553 (-3.7A)
None
1PE  A1553 ( 3.7A)
None
None
 0.93A 5l0zA-4be9A:
undetectable		 5l0zA-4be9A:
17.72
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.
5MZJ_A_TEPA2401_1
(ADENOSINE RECEPTOR
A2A,SOLUBLE
CYTOCHROME
B562,ADENOSINE
RECEPTOR A2A)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		4 / 8 PHE A 373
MET A 425
LEU A 418
ILE A 363
 None
 0.96A 5mzjA-4be9A:
undetectable		 5mzjA-4be9A:
21.93
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.
5YOD_B_BEZB201_0
(NS3 PROTEASE)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		4 / 5 HIS A 272
ALA A 300
SER A 303
GLY A  80
 None
 0.96A 5yodB-4be9A:
undetectable		 5yodB-4be9A:
16.88
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.
5YOD_D_BEZD201_0
(NS3 PROTEASE)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		4 / 5 HIS A 272
ALA A 300
SER A 303
GLY A  80
 None
 1.06A 5yodD-4be9A:
undetectable		 5yodD-4be9A:
16.88
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.
5YOD_F_BEZF201_0
(NS3 PROTEASE)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		4 / 5 ALA A 314
SER A 311
TYR A 310
TYR A 372
 None
None
NAG  A1550 (-3.8A)
None
 1.41A 5yodF-4be9A:
undetectable		 5yodF-4be9A:
16.88
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.
5YW0_A_ACTA409_0
(UNCHARACTERIZED
PROTEIN KDOO)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		3 / 3 ASP A 424
PHE A 532
ARG A 431
 None
GOL  A1556 ( 3.7A)
None
 0.94A 5yw0A-4be9A:
undetectable		 5yw0A-4be9A:
20.61
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.
5YW0_A_ACTA409_0
(UNCHARACTERIZED
PROTEIN KDOO)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		3 / 3 ASP A 424
PHE A 532
ARG A 432
 None
GOL  A1556 ( 3.7A)
None
 1.10A 5yw0A-4be9A:
undetectable		 5yw0A-4be9A:
20.61
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.
6E43_B_BEZB502_0
(INDOLEAMINE
2,3-DIOXYGENASE 1)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		4 / 6 PHE A 297
LEU A 286
LEU A 289
ARG A 290
 None
 1.03A 6e43B-4be9A:
undetectable		 6e43B-4be9A:
23.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6E43_D_BEZD502_0
(INDOLEAMINE
2,3-DIOXYGENASE 1)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		4 / 6 PHE A 297
LEU A 286
LEU A 289
ARG A 290
 None
 1.01A 6e43D-4be9A:
undetectable		 6e43D-4be9A:
23.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6GNF_A_QPSA602_2
(-)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		5 / 9 THR A 426
GLY A 423
GLY A 353
VAL A 358
GLU A 219
 1PE  A1553 (-3.7A)
None
None
None
None
 1.45A 6gnfA-4be9A:
2.9		 6gnfA-4be9A:
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.
6JMJ_A_ASCA201_0
(PHOSPHOPANTETHEINE
ADENYLYLTRANSFERASE)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		4 / 5 GLY A 139
THR A 140
SER A 105
SER A 104
 None
 1.13A 6jmjA-4be9A:
undetectable		 6jmjA-4be9A:
15.36
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.
6QGB_A_BEZA701_0
(MONO(2-HYDROXYETHYL)
TEREPHTHALATE
HYDROLASE)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		5 / 11 GLY A 135
SER A 220
SER A 312
PHE A 427
HIS A 465
 1PE  A1553 (-3.3A)
1PE  A1553 (-2.9A)
None
1PE  A1553 (-4.7A)
None
 0.98A 6qgbA-4be9A:
1.8		 6qgbA-4be9A:
22.78
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.
6QGB_B_BEZB802_0
(MONO(2-HYDROXYETHYL)
TEREPHTHALATE
HYDROLASE)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		5 / 10 GLY A 135
SER A 220
SER A 312
PHE A 427
HIS A 465
 1PE  A1553 (-3.3A)
1PE  A1553 (-2.9A)
None
1PE  A1553 (-4.7A)
None
 0.98A 6qgbB-4be9A:
10.2		 6qgbB-4be9A:
22.78
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.
6QGB_C_BEZC701_0
(MONO(2-HYDROXYETHYL)
TEREPHTHALATE
HYDROLASE)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		5 / 9 GLY A 135
SER A 220
SER A 312
PHE A 427
HIS A 465
 1PE  A1553 (-3.3A)
1PE  A1553 (-2.9A)
None
1PE  A1553 (-4.7A)
None
 0.99A 6qgbC-4be9A:
3.7		 6qgbC-4be9A:
22.78
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.
6QGB_D_BEZD701_0
(MONO(2-HYDROXYETHYL)
TEREPHTHALATE
HYDROLASE)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		5 / 10 GLY A 135
SER A 220
SER A 312
PHE A 427
HIS A 465
 1PE  A1553 (-3.3A)
1PE  A1553 (-2.9A)
None
1PE  A1553 (-4.7A)
None
 0.99A 6qgbD-4be9A:
3.2		 6qgbD-4be9A:
22.78
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.
6QGB_E_BEZE701_0
(MONO(2-HYDROXYETHYL)
TEREPHTHALATE
HYDROLASE)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		5 / 11 GLY A 135
SER A 220
SER A 312
PHE A 427
HIS A 465
 1PE  A1553 (-3.3A)
1PE  A1553 (-2.9A)
None
1PE  A1553 (-4.7A)
None
 0.97A 6qgbE-4be9A:
10.8		 6qgbE-4be9A:
22.78
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.
6QGB_F_BEZF701_0
(MONO(2-HYDROXYETHYL)
TEREPHTHALATE
HYDROLASE)		 4be9 STEROL ESTERASE
(Ophiostoma
piceae) 		5 / 10 GLY A 135
SER A 220
SER A 312
PHE A 427
HIS A 465
 1PE  A1553 (-3.3A)
1PE  A1553 (-2.9A)
None
1PE  A1553 (-4.7A)
None
 0.96A 6qgbF-4be9A:
8.4		 6qgbF-4be9A:
22.78