SIMILAR PATTERNS OF AMINO ACIDS FOR 2OXT_D_SAMD300

List of similar pattern of amino acids derived from ASSAM search

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 link on the last column to view superposed patterns of amino acids in NGL viewer)
(Note that only 3-12 residue patterns can be used for ASSAM searches)
Filter list by:
Hit Macromolecule/
Organism		 Pfam Res. 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.
1dwa MYROSINASE MA1

(Sinapis alba) 		PF00232
(Glyco_hydro_1) 		6 GLY M  47
ASP M  70
GLY M  69
THR M  72
GLU M  41
ASP M  52
 None
ZN  M 923 (-2.2A)
None
None
None
None
 1.27A 2oxtD-1dwaM:
undetectable		 2oxtD-1dwaM:
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.
1eiz FTSJ

(Escherichia
coli) 		PF01728
(FtsJ) 		5 ASP A  57
GLY A  59
GLY A  64
LEU A  84
ASP A 124
 None
SAM  A 301 (-3.6A)
SAM  A 301 (-3.1A)
SAM  A 301 (-4.2A)
SAM  A 301 (-3.6A)
 0.59A 2oxtD-1eizA:
15.2		 2oxtD-1eizA:
24.24
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.
1elv COMPLEMENT C1S
COMPONENT

(Homo sapiens) 		PF00084
(Sushi)
PF00089
(Trypsin) 		6 GLY A 556
GLY A 447
GLY A 618
GLY A 615
THR A 457
LEU A 456
 None
None
None
SO4  A2001 (-4.1A)
None
None
 1.41A 2oxtD-1elvA:
undetectable		 2oxtD-1elvA:
20.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1eq9 CHYMOTRYPSIN

(Solenopsis
invicta) 		PF00089
(Trypsin) 		6 GLY A 142
GLY A 196
GLY A 193
THR A  54
LEU A  53
VAL A  31
 None
None
PMS  A1201 (-4.0A)
None
None
None
 1.34A 2oxtD-1eq9A:
undetectable		 2oxtD-1eq9A:
20.37
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.
1euf DUODENASE

(Bos taurus) 		PF00089
(Trypsin) 		6 GLY A 142
GLY A  44
GLY A 196
GLY A 193
THR A  54
LEU A  53
 None
 1.48A 2oxtD-1eufA:
undetectable		 2oxtD-1eufA:
21.43
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.
1fi8 NATURAL KILLER CELL
PROTEASE 1

(Rattus
norvegicus) 		PF00089
(Trypsin) 		6 GLY A 142
GLY A  44
GLY A 196
GLY A 193
THR A  54
LEU A  53
 None
 1.44A 2oxtD-1fi8A:
undetectable		 2oxtD-1fi8A:
21.38
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.
1fiz BETA-ACROSIN HEAVY
CHAIN

(Sus scrofa) 		PF00089
(Trypsin) 		6 GLY A 142
GLY A  44
GLY A 196
GLY A 193
THR A  54
LEU A  53
 None
 1.40A 2oxtD-1fizA:
undetectable		 2oxtD-1fizA:
19.72
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.
1fpq ISOLIQUIRITIGENIN
2'-O-METHYLTRANSFERA
SE

(Medicago sativa) 		PF00891
(Methyltransf_2)
PF08100
(Dimerisation) 		5 ASP A 215
GLY A 217
GLY A 219
LEU A 241
VAL A 276
 None
SAM  A1699 (-3.6A)
None
SAM  A1699 (-4.2A)
SAM  A1699 ( 4.7A)
 0.74A 2oxtD-1fpqA:
7.8		 2oxtD-1fpqA:
20.95
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.
1fuj PR3

(Homo sapiens) 		PF00089
(Trypsin) 		6 GLY A 142
GLY A  44
GLY A 196
GLY A 193
THR A  54
LEU A  53
 None
 1.35A 2oxtD-1fujA:
undetectable		 2oxtD-1fujA:
19.15
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.
1hyl HYPODERMA LINEATUM
COLLAGENASE

(Hypoderma
lineatum) 		PF00089
(Trypsin) 		6 GLY A 142
GLY A  44
GLY A 196
GLY A 193
THR A  54
LEU A  53
 None
 1.45A 2oxtD-1hylA:
undetectable		 2oxtD-1hylA:
19.26
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.
1id5 THROMBIN

(Bos taurus) 		PF00089
(Trypsin) 		6 GLY H 142
GLY H 196
GLY H 193
THR H  54
LEU H  53
VAL H  31
 None
 1.35A 2oxtD-1id5H:
undetectable		 2oxtD-1id5H:
20.52
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.
1kig FACTOR XA

(Bos taurus) 		PF00089
(Trypsin) 		6 GLY H 142
GLY H  44
GLY H 196
GLY H 193
THR H  54
LEU H  53
 None
 1.42A 2oxtD-1kigH:
undetectable		 2oxtD-1kigH:
18.84
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.
1kpi CYCLOPROPANE-FATTY-A
CYL-PHOSPHOLIPID
SYNTHASE 2

(Mycobacterium
tuberculosis) 		PF02353
(CMAS) 		5 ASP A  78
GLY A  80
GLY A  82
THR A 102
LEU A 103
 SAH  A 900 ( 4.8A)
SAH  A 900 (-3.3A)
SAH  A 900 (-3.1A)
SAH  A 900 (-4.0A)
SAH  A 900 (-4.4A)
 0.83A 2oxtD-1kpiA:
8.0		 2oxtD-1kpiA:
22.87
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.
1npm NEUROPSIN

(Mus musculus) 		PF00089
(Trypsin) 		6 GLY A 142
GLY A  44
GLY A 196
GLY A 193
THR A  54
LEU A  53
 None
 1.39A 2oxtD-1npmA:
undetectable		 2oxtD-1npmA:
21.11
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.
1o5f SERINE PROTEASE
HEPSIN

(Homo sapiens) 		PF00089
(Trypsin) 		6 GLY H 142
GLY H  44
GLY H 196
GLY H 193
THR H  54
LEU H  53
 None
 1.44A 2oxtD-1o5fH:
undetectable		 2oxtD-1o5fH:
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.
1pq5 TRYPSIN

(Fusarium
oxysporum) 		PF00089
(Trypsin) 		6 GLY A 139
GLY A  43
GLY A 196
GLY A 193
THR A  53
LEU A  52
 None
None
None
ARG  A 703 (-3.6A)
None
None
 1.44A 2oxtD-1pq5A:
undetectable		 2oxtD-1pq5A:
21.75
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.
1q3x MANNAN-BINDING
LECTIN SERINE
PROTEASE 2

(Homo sapiens) 		PF00084
(Sushi)
PF00089
(Trypsin) 		6 GLY A 574
GLY A 470
GLY A 634
GLY A 631
THR A 480
LEU A 479
 None
 1.35A 2oxtD-1q3xA:
undetectable		 2oxtD-1q3xA:
22.88
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.
1qzz ACLACINOMYCIN-10-HYD
ROXYLASE

(Streptomyces
purpurascens) 		PF00891
(Methyltransf_2) 		6 ASP A 188
GLY A 190
GLY A 192
GLY A 195
LEU A 214
VAL A 257
 ACT  A 421 (-2.8A)
SAM  A 635 (-3.8A)
SAM  A 635 (-3.5A)
ACT  A 421 (-3.9A)
SAM  A 635 (-4.2A)
SAM  A 635 ( 4.7A)
 0.74A 2oxtD-1qzzA:
8.9		 2oxtD-1qzzA:
21.01
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1r6a GENOME POLYPROTEIN

(Dengue virus) 		PF01728
(FtsJ) 		6 ASP A  79
GLY A  81
GLY A  85
HIS A 110
GLU A 111
ASP A 146
 SAH  A 887 ( 4.8A)
SAH  A 887 (-3.6A)
SAH  A 887 ( 4.3A)
SO4  A 901 ( 3.9A)
None
SAH  A 887 (-3.9A)
 1.16A 2oxtD-1r6aA:
39.1		 2oxtD-1r6aA:
48.70
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1r6a GENOME POLYPROTEIN

(Dengue virus) 		PF01728
(FtsJ) 		9 GLY A  58
ASP A  79
GLY A  81
GLY A  83
GLY A  86
THR A 104
HIS A 110
GLU A 111
ASP A 146
 SAH  A 887 (-3.0A)
SAH  A 887 ( 4.8A)
SAH  A 887 (-3.6A)
SAH  A 887 (-3.6A)
SAH  A 887 (-3.3A)
SAH  A 887 (-4.5A)
SO4  A 901 ( 3.9A)
None
SAH  A 887 (-3.9A)
 0.43A 2oxtD-1r6aA:
39.1		 2oxtD-1r6aA:
48.70
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.
1ri6 PUTATIVE ISOMERASE
YBHE

(Escherichia
coli) 		PF10282
(Lactonase) 		6 GLY A 322
GLY A 281
GLY A 295
GLY A 324
GLU A 276
VAL A 328
 None
 1.20A 2oxtD-1ri6A:
undetectable		 2oxtD-1ri6A:
22.87
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.
1spj KALLIKREIN 1

(Homo sapiens) 		PF00089
(Trypsin) 		6 GLY A 142
GLY A  44
GLY A 196
GLY A 193
THR A  54
LEU A  53
 None
 1.43A 2oxtD-1spjA:
undetectable		 2oxtD-1spjA:
19.37
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.
1zlr COAGULATION FACTOR
XI

(Homo sapiens) 		PF00089
(Trypsin) 		6 GLY A 142
GLY A  42
GLY A 196
GLY A 193
THR A  54
LEU A  53
 None
None
None
368  A 901 (-3.3A)
None
None
 1.40A 2oxtD-1zlrA:
undetectable		 2oxtD-1zlrA:
22.03
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.
2aip PROTEIN C ACTIVATOR

(Agkistrodon
contortrix) 		PF00089
(Trypsin) 		6 GLY A 142
GLY A  44
GLY A 196
GLY A 193
THR A  54
LEU A  53
 None
None
None
SO4  A 301 (-3.9A)
None
None
 1.42A 2oxtD-2aipA:
undetectable		 2oxtD-2aipA:
21.72
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.
2ei8 COAGULATION FACTOR
X, HEAVY CHAIN

(Homo sapiens) 		PF00089
(Trypsin) 		6 GLY A 142
GLY A  44
GLY A 196
GLY A 193
THR A  54
LEU A  53
 None
 1.37A 2oxtD-2ei8A:
undetectable		 2oxtD-2ei8A:
20.79
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.
2gqd 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 2

(Staphylococcus
aureus) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		6 GLY A 344
GLY A 109
GLY A 111
THR A 167
HIS A 403
HIS A 304
 None
 1.35A 2oxtD-2gqdA:
undetectable		 2oxtD-2gqdA:
21.38
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.
2hcf HYDROLASE, HALOACID
DEHALOGENASE-LIKE
FAMILY

(Chlorobaculum
tepidum) 		PF13419
(HAD_2) 		5 ASP A   9
GLY A  46
GLY A 117
THR A 178
ASP A  11
 MG  A 300 (-2.5A)
MG  A 300 ( 4.7A)
None
MG  A 300 ( 4.8A)
None
 0.72A 2oxtD-2hcfA:
undetectable		 2oxtD-2hcfA:
20.77
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2oxt NUCLEOSIDE-2'-O-METH
YLTRANSFERASE

(Meaban virus) 		PF01728
(FtsJ) 		8 ASP A  80
GLY A  82
GLY A  84
GLY A  86
GLU A 112
HIS A 134
ASP A 147
VAL A 148
 SAM  A 300 ( 4.6A)
SAM  A 300 (-3.3A)
SAM  A 300 (-3.5A)
SAM  A 300 ( 4.6A)
None
SAM  A 300 (-4.3A)
SAM  A 300 (-3.9A)
SAM  A 300 (-4.2A)
 1.04A 2oxtD-2oxtA:
45.2		 2oxtD-2oxtA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2oxt NUCLEOSIDE-2'-O-METH
YLTRANSFERASE

(Meaban virus) 		PF01728
(FtsJ) 		12 GLY A  59
ASP A  80
GLY A  82
GLY A  84
GLY A  87
THR A 105
LEU A 106
HIS A 111
GLU A 112
HIS A 134
ASP A 147
VAL A 148
 SAM  A 300 (-3.1A)
SAM  A 300 ( 4.6A)
SAM  A 300 (-3.3A)
SAM  A 300 (-3.5A)
SAM  A 300 (-3.2A)
SAM  A 300 (-4.6A)
SAM  A 300 (-4.2A)
SAM  A 300 (-3.6A)
None
SAM  A 300 (-4.3A)
SAM  A 300 (-3.9A)
SAM  A 300 (-4.2A)
 0.50A 2oxtD-2oxtA:
45.2		 2oxtD-2oxtA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2oxt NUCLEOSIDE-2'-O-METH
YLTRANSFERASE

(Meaban virus) 		PF01728
(FtsJ) 		6 GLY A  59
HIS A 111
GLU A 112
HIS A 134
ASP A 147
VAL A 148
 SAM  A 300 (-3.1A)
SAM  A 300 (-3.6A)
None
SAM  A 300 (-4.3A)
SAM  A 300 (-3.9A)
SAM  A 300 (-4.2A)
 1.49A 2oxtD-2oxtA:
45.2		 2oxtD-2oxtA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2oxt NUCLEOSIDE-2'-O-METH
YLTRANSFERASE

(Meaban virus) 		PF01728
(FtsJ) 		6 GLY A  82
GLY A  59
GLY A  87
GLY A  84
THR A  60
ASP A 147
 SAM  A 300 (-3.3A)
SAM  A 300 (-3.1A)
SAM  A 300 (-3.2A)
SAM  A 300 (-3.5A)
None
SAM  A 300 (-3.9A)
 1.45A 2oxtD-2oxtA:
45.2		 2oxtD-2oxtA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2oxt NUCLEOSIDE-2'-O-METH
YLTRANSFERASE

(Meaban virus) 		PF01728
(FtsJ) 		6 GLY A  87
LEU A 106
HIS A 111
GLU A 112
HIS A 134
VAL A 148
 SAM  A 300 (-3.2A)
SAM  A 300 (-4.2A)
SAM  A 300 (-3.6A)
None
SAM  A 300 (-4.3A)
SAM  A 300 (-4.2A)
 1.39A 2oxtD-2oxtA:
45.2		 2oxtD-2oxtA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2oy0 METHYLTRANSFERASE

(West Nile virus) 		PF01728
(FtsJ) 		6 ASP A  79
GLY A  81
GLY A  83
GLY A  85
HIS A 110
ASP A 146
 None
SAH  A 301 (-3.0A)
SAH  A 301 (-3.2A)
SAH  A 301 (-4.3A)
SAH  A 301 (-4.4A)
SAH  A 301 (-4.2A)
 1.08A 2oxtD-2oy0A:
38.6		 2oxtD-2oy0A:
51.69
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2oy0 METHYLTRANSFERASE

(West Nile virus) 		PF01728
(FtsJ) 		8 GLY A  58
ASP A  79
GLY A  81
GLY A  83
GLY A  86
THR A 104
HIS A 110
ASP A 146
 SAH  A 301 (-3.4A)
None
SAH  A 301 (-3.0A)
SAH  A 301 (-3.2A)
SAH  A 301 (-3.0A)
SAH  A 301 (-4.4A)
SAH  A 301 (-4.4A)
SAH  A 301 (-4.2A)
 0.45A 2oxtD-2oy0A:
38.6		 2oxtD-2oy0A:
51.69
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2oy0 METHYLTRANSFERASE

(West Nile virus) 		PF01728
(FtsJ) 		7 GLY A  58
ASP A  79
GLY A  83
GLY A  86
THR A 104
GLU A 111
ASP A 146
 SAH  A 301 (-3.4A)
None
SAH  A 301 (-3.2A)
SAH  A 301 (-3.0A)
SAH  A 301 (-4.4A)
SAH  A 301 (-3.5A)
SAH  A 301 (-4.2A)
 0.92A 2oxtD-2oy0A:
38.6		 2oxtD-2oy0A:
51.69
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2oy0 METHYLTRANSFERASE

(West Nile virus) 		PF01728
(FtsJ) 		6 GLY A  81
GLY A  58
GLY A  86
GLY A  83
THR A  59
ASP A 146
 SAH  A 301 (-3.0A)
SAH  A 301 (-3.4A)
SAH  A 301 (-3.0A)
SAH  A 301 (-3.2A)
None
SAH  A 301 (-4.2A)
 1.44A 2oxtD-2oy0A:
38.6		 2oxtD-2oy0A:
51.69
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2px5 GENOME POLYPROTEIN
[CONTAINS: CAPSID
PROTEIN C (CORE
PROTEIN)
ENVELOPE PROTEIN M
(MATRIX PROTEIN)
MAJOR ENVELOPE
PROTEIN E
NON-STRUCTURAL
PROTEIN 1 (NS1)
NON-STRUCTURAL
PROTEIN 2A (NS2A)
FLAVIVIRIN PROTEASE
NS2B REGULATORY
SUBUNIT
FLAVIVIRIN PROTEASE
NS3 CATALYTIC
SUBUNIT
NON-STRUCTURAL
PROTEIN 4A (NS4A)
NON-STRUCTURAL
PROTEIN 4B (NS4B)
RNA-DIRECTED RNA
POLYMERASE (EC
2.7.7.48) (NS5)]

(Murray Valley
encephalitis
virus) 		PF01728
(FtsJ) 		8 GLY A  58
ASP A  79
GLY A  81
GLY A  83
GLY A  86
THR A 104
HIS A 110
ASP A 146
 SAH  A 500 (-3.3A)
SAH  A 500 ( 4.7A)
SAH  A 500 (-3.4A)
SAH  A 500 ( 3.7A)
SAH  A 500 (-3.2A)
SAH  A 500 ( 4.6A)
SAH  A 500 (-3.9A)
SAH  A 500 (-3.6A)
 0.56A 2oxtD-2px5A:
39.7		 2oxtD-2px5A:
51.31
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2px5 GENOME POLYPROTEIN
[CONTAINS: CAPSID
PROTEIN C (CORE
PROTEIN)
ENVELOPE PROTEIN M
(MATRIX PROTEIN)
MAJOR ENVELOPE
PROTEIN E
NON-STRUCTURAL
PROTEIN 1 (NS1)
NON-STRUCTURAL
PROTEIN 2A (NS2A)
FLAVIVIRIN PROTEASE
NS2B REGULATORY
SUBUNIT
FLAVIVIRIN PROTEASE
NS3 CATALYTIC
SUBUNIT
NON-STRUCTURAL
PROTEIN 4A (NS4A)
NON-STRUCTURAL
PROTEIN 4B (NS4B)
RNA-DIRECTED RNA
POLYMERASE (EC
2.7.7.48) (NS5)]

(Murray Valley
encephalitis
virus) 		PF01728
(FtsJ) 		6 GLY A  58
ASP A  79
GLY A  83
GLY A  86
GLU A 111
ASP A 146
 SAH  A 500 (-3.3A)
SAH  A 500 ( 4.7A)
SAH  A 500 ( 3.7A)
SAH  A 500 (-3.2A)
SAH  A 500 ( 3.2A)
SAH  A 500 (-3.6A)
 0.89A 2oxtD-2px5A:
39.7		 2oxtD-2px5A:
51.31
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2px5 GENOME POLYPROTEIN
[CONTAINS: CAPSID
PROTEIN C (CORE
PROTEIN)
ENVELOPE PROTEIN M
(MATRIX PROTEIN)
MAJOR ENVELOPE
PROTEIN E
NON-STRUCTURAL
PROTEIN 1 (NS1)
NON-STRUCTURAL
PROTEIN 2A (NS2A)
FLAVIVIRIN PROTEASE
NS2B REGULATORY
SUBUNIT
FLAVIVIRIN PROTEASE
NS3 CATALYTIC
SUBUNIT
NON-STRUCTURAL
PROTEIN 4A (NS4A)
NON-STRUCTURAL
PROTEIN 4B (NS4B)
RNA-DIRECTED RNA
POLYMERASE (EC
2.7.7.48) (NS5)]

(Murray Valley
encephalitis
virus) 		PF01728
(FtsJ) 		6 GLY A  81
GLY A  58
GLY A  86
GLY A  83
THR A  59
ASP A 146
 SAH  A 500 (-3.4A)
SAH  A 500 (-3.3A)
SAH  A 500 (-3.2A)
SAH  A 500 ( 3.7A)
None
SAH  A 500 (-3.6A)
 1.42A 2oxtD-2px5A:
39.7		 2oxtD-2px5A:
51.31
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.
2qua EXTRACELLULAR LIPASE

(Serratia
marcescens) 		no annotation 6 GLY A  44
GLY A  39
THR A  52
LEU A  51
GLU A  38
VAL A 349
 None
 1.09A 2oxtD-2quaA:
undetectable		 2oxtD-2quaA:
17.56
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2wa2 NON-STRUCTURAL
PROTEIN 5

(Modoc virus) 		PF01728
(FtsJ) 		9 GLY A  59
ASP A  80
GLY A  82
GLY A  84
THR A 105
LEU A 106
HIS A 111
GLU A 112
ASP A 147
 SAM  A1248 ( 3.7A)
SAM  A1248 ( 4.9A)
SAM  A1248 (-3.3A)
SAM  A1248 (-3.4A)
SAM  A1248 (-4.5A)
SAM  A1248 (-4.1A)
SAM  A1248 (-3.8A)
None
SAM  A1248 (-3.7A)
 0.42A 2oxtD-2wa2A:
34.8		 2oxtD-2wa2A:
53.21
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.
2zgh GRANZYME M

(Homo sapiens) 		PF00089
(Trypsin) 		6 GLY A 126
GLY A  28
GLY A 183
GLY A 180
THR A  38
LEU A  37
 None
 1.44A 2oxtD-2zghA:
undetectable		 2oxtD-2zghA:
18.98
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.
3beu TRYPSIN

(Streptomyces
griseus) 		PF00089
(Trypsin) 		6 GLY A 142
GLY A  44
GLY A 196
GLY A 193
THR A  54
LEU A  53
 None
None
None
SO4  A 246 (-3.6A)
None
None
 1.44A 2oxtD-3beuA:
undetectable		 2oxtD-3beuA:
21.96
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3elu METHYLTRANSFERASE

(Wesselsbron
virus) 		PF00972
(Flavi_NS5)
PF01728
(FtsJ) 		10 GLY A  58
ASP A  79
GLY A  81
GLY A  83
GLY A  86
THR A 104
LEU A 105
HIS A 110
GLU A 111
ASP A 146
 SAM  A4633 ( 3.7A)
None
SAM  A4633 (-3.2A)
SAM  A4633 (-3.4A)
SAM  A4633 (-3.4A)
SAM  A4633 (-4.5A)
SAM  A4633 (-4.1A)
SAM  A4633 (-3.6A)
None
SAM  A4633 (-3.7A)
 0.59A 2oxtD-3eluA:
38.8		 2oxtD-3eluA:
49.82
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3evc RNA-DIRECTED RNA
POLYMERASE NS5

(Yellow fever
virus) 		PF01728
(FtsJ) 		6 ASP A  79
GLY A  81
GLY A  85
HIS A 110
HIS A 133
ASP A 146
 SAH  A 901 ( 4.9A)
SAH  A 901 (-3.4A)
SAH  A 901 ( 4.4A)
SAH  A 901 (-3.8A)
SAH  A 901 (-4.2A)
SAH  A 901 (-3.8A)
 1.06A 2oxtD-3evcA:
39.8		 2oxtD-3evcA:
48.89
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3evc RNA-DIRECTED RNA
POLYMERASE NS5

(Yellow fever
virus) 		PF01728
(FtsJ) 		10 GLY A  58
ASP A  79
GLY A  81
GLY A  83
GLY A  86
THR A 104
LEU A 105
HIS A 110
HIS A 133
ASP A 146
 SAH  A 901 (-3.2A)
SAH  A 901 ( 4.9A)
SAH  A 901 (-3.4A)
SAH  A 901 (-3.3A)
SAH  A 901 (-3.1A)
SAH  A 901 (-4.5A)
SAH  A 901 (-4.0A)
SAH  A 901 (-3.8A)
SAH  A 901 (-4.2A)
SAH  A 901 (-3.8A)
 0.34A 2oxtD-3evcA:
39.8		 2oxtD-3evcA:
48.89
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3evc RNA-DIRECTED RNA
POLYMERASE NS5

(Yellow fever
virus) 		PF01728
(FtsJ) 		6 GLY A  81
GLY A  58
GLY A  86
GLY A  83
THR A  59
ASP A 146
 SAH  A 901 (-3.4A)
SAH  A 901 (-3.2A)
SAH  A 901 (-3.1A)
SAH  A 901 (-3.3A)
None
SAH  A 901 (-3.8A)
 1.40A 2oxtD-3evcA:
39.8		 2oxtD-3evcA:
48.89
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.
3f4k PUTATIVE
METHYLTRANSFERASE

(Bacteroides
thetaiotaomicron) 		PF13649
(Methyltransf_25) 		5 ASP A  52
GLY A  54
GLY A  56
GLY A  59
LEU A  77
 None
 0.72A 2oxtD-3f4kA:
9.0		 2oxtD-3f4kA:
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.
3f6u VITAMIN K-DEPENDENT
PROTEIN C HEAVY
CHAIN

(Homo sapiens) 		PF00089
(Trypsin) 		6 GLY H 142
GLY H 196
GLY H 193
THR H  54
LEU H  53
VAL H  31
 None
None
0G6  H   1 (-4.1A)
None
None
None
 1.22A 2oxtD-3f6uH:
undetectable		 2oxtD-3f6uH:
20.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3gcz POLYPROTEIN

(Yokose virus) 		PF01728
(FtsJ) 		10 GLY A  58
ASP A  79
GLY A  81
GLY A  83
GLY A  86
THR A 104
LEU A 105
HIS A 110
GLU A 111
ASP A 146
 SAM  A4633 (-3.5A)
None
SAM  A4633 (-3.4A)
SAM  A4633 (-3.4A)
SAM  A4633 (-3.2A)
SAM  A4633 (-4.5A)
SAM  A4633 (-4.0A)
SAM  A4633 (-3.5A)
None
SAM  A4633 (-3.7A)
 0.52A 2oxtD-3gczA:
40.6		 2oxtD-3gczA:
49.07
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.
3gq9 PRENECK APPENDAGE
PROTEIN

(Bacillus virus
phi29) 		PF11962
(Peptidase_G2)
PF12708
(Pectate_lyase_3) 		6 GLY A 366
GLY A 257
GLY A 255
GLY A 338
THR A 258
VAL A 376
 None
 1.17A 2oxtD-3gq9A:
undetectable		 2oxtD-3gq9A:
18.97
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.
3hi0 PUTATIVE
EXOPOLYPHOSPHATASE

(Agrobacterium
fabrum) 		PF02541
(Ppx-GppA) 		5 GLY A  53
GLY A 171
GLY A 149
GLY A  51
LEU A 151
 None
 0.81A 2oxtD-3hi0A:
undetectable		 2oxtD-3hi0A:
19.88
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.
3hp7 HEMOLYSIN, PUTATIVE

(Streptococcus
thermophilus) 		PF01479
(S4)
PF01728
(FtsJ) 		6 GLY A  66
ASP A  88
GLY A  90
GLY A  95
ASP A 155
VAL A 156
 None
None
EOH  A 301 ( 3.7A)
None
None
None
 0.73A 2oxtD-3hp7A:
13.3		 2oxtD-3hp7A:
24.07
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.
3i58 O-METHYLTRANSFERASE

(Streptomyces
carzinostaticus) 		PF00891
(Methyltransf_2) 		6 ASP A 175
GLY A 177
GLY A 179
GLY A 182
LEU A 201
VAL A 244
 SAH  A 401 ( 4.2A)
SAH  A 401 (-3.9A)
SAH  A 401 (-3.6A)
None
SAH  A 401 (-4.4A)
SAH  A 401 ( 4.5A)
 0.83A 2oxtD-3i58A:
7.2		 2oxtD-3i58A:
20.51
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3lkz NON-STRUCTURAL
PROTEIN 5

(West Nile virus) 		PF01728
(FtsJ) 		8 GLY A  58
ASP A  79
GLY A  81
GLY A  83
GLY A  86
THR A 104
HIS A 110
ASP A 146
 SFG  A 301 (-2.9A)
SFG  A 301 ( 4.9A)
SFG  A 301 (-3.5A)
SFG  A 301 (-3.3A)
SFG  A 301 (-3.4A)
SFG  A 301 ( 4.7A)
SFG  A 301 (-3.9A)
SFG  A 301 (-3.8A)
 0.46A 2oxtD-3lkzA:
39.7		 2oxtD-3lkzA:
50.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3lkz NON-STRUCTURAL
PROTEIN 5

(West Nile virus) 		PF01728
(FtsJ) 		7 GLY A  58
ASP A  79
GLY A  83
GLY A  86
THR A 104
GLU A 111
ASP A 146
 SFG  A 301 (-2.9A)
SFG  A 301 ( 4.9A)
SFG  A 301 (-3.3A)
SFG  A 301 (-3.4A)
SFG  A 301 ( 4.7A)
SFG  A 301 (-3.7A)
SFG  A 301 (-3.8A)
 0.92A 2oxtD-3lkzA:
39.7		 2oxtD-3lkzA:
50.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3lkz NON-STRUCTURAL
PROTEIN 5

(West Nile virus) 		PF01728
(FtsJ) 		6 GLY A  81
GLY A  58
GLY A  86
GLY A  83
THR A  59
ASP A 146
 SFG  A 301 (-3.5A)
SFG  A 301 (-2.9A)
SFG  A 301 (-3.4A)
SFG  A 301 (-3.3A)
None
SFG  A 301 (-3.8A)
 1.44A 2oxtD-3lkzA:
39.7		 2oxtD-3lkzA:
50.00
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.
3opn PUTATIVE HEMOLYSIN

(Lactococcus
lactis) 		PF01728
(FtsJ) 		6 GLY A  40
ASP A  62
GLY A  64
GLY A  69
ASP A 129
VAL A 130
 SO4  A   1 (-3.5A)
None
None
SO4  A   1 (-3.3A)
None
None
 0.82A 2oxtD-3opnA:
13.9		 2oxtD-3opnA:
21.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3r3g THROMBIN HEAVY CHAIN

(Homo sapiens) 		PF00089
(Trypsin) 		6 GLY B 142
GLY B 196
GLY B 193
THR B  54
LEU B  53
VAL B  31
 None
 1.31A 2oxtD-3r3gB:
undetectable		 2oxtD-3r3gB:
20.92
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.
3rp2 RAT MAST CELL
PROTEASE II

(Rattus rattus) 		PF00089
(Trypsin) 		6 GLY A 142
GLY A  44
GLY A 196
GLY A 193
THR A  54
LEU A  53
 None
 1.42A 2oxtD-3rp2A:
undetectable		 2oxtD-3rp2A:
23.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3s69 THROMBIN-LIKE ENZYME
DEFIBRASE

(Gloydius
saxatilis) 		PF00089
(Trypsin) 		6 GLY A 139
GLY A  43
GLY A 196
GLY A 193
THR A  53
LEU A  52
 None
 1.44A 2oxtD-3s69A:
undetectable		 2oxtD-3s69A:
20.95
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.
3s9b VIPERA RUSSELLI
PROTEINASE RVV-V
GAMMA

(Daboia
siamensis) 		PF00089
(Trypsin) 		6 GLY A 142
GLY A  44
GLY A 196
GLY A 193
THR A  54
LEU A  53
 None
 1.38A 2oxtD-3s9bA:
undetectable		 2oxtD-3s9bA:
19.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3suc PRENECK APPENDAGE
PROTEIN

(Bacillus virus
phi29) 		PF11962
(Peptidase_G2)
PF12708
(Pectate_lyase_3) 		6 GLY A 366
GLY A 257
GLY A 255
GLY A 338
THR A 258
VAL A 376
 None
 1.25A 2oxtD-3sucA:
undetectable		 2oxtD-3sucA:
16.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3vc1 GERANYL DIPHOSPHATE
2-C-METHYLTRANSFERAS
E

(Streptomyces
coelicolor) 		PF08241
(Methyltransf_11) 		6 ASP A 103
GLY A 105
GLY A 107
GLY A 110
THR A 127
LEU A 128
 SAH  A 302 ( 4.1A)
SAH  A 302 (-3.4A)
SAH  A 302 (-3.3A)
None
SAH  A 302 (-4.0A)
SAH  A 302 (-4.1A)
 0.85A 2oxtD-3vc1A:
8.7		 2oxtD-3vc1A:
21.58
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.
4bxw FACTOR XA

(Pseudonaja
textilis) 		PF00089
(Trypsin)
PF14670
(FXa_inhibition) 		6 GLY A 308
GLY A 198
GLY A 363
GLY A 360
THR A 208
LEU A 207
 None
None
None
0GJ  A1411 (-3.8A)
None
None
 1.45A 2oxtD-4bxwA:
undetectable		 2oxtD-4bxwA:
19.86
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.
4e7n SNAKE-VENOM
THROMBIN-LIKE ENZYME

(Gloydius halys) 		PF00089
(Trypsin) 		6 GLY A 142
GLY A  44
GLY A 196
GLY A 193
THR A  54
LEU A  53
 None
 1.41A 2oxtD-4e7nA:
undetectable		 2oxtD-4e7nA:
22.22
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.
4evi CONIFERYL ALCOHOL
9-O-METHYLTRANSFERAS
E

(Linum
nodiflorum) 		PF00891
(Methyltransf_2)
PF08100
(Dimerisation) 		6 ASP A 206
GLY A 208
GLY A 210
GLY A 212
LEU A 232
VAL A 269
 None
SAH  A 401 (-3.6A)
SAH  A 401 ( 3.8A)
None
SAH  A 401 ( 4.4A)
SAH  A 401 ( 4.5A)
 1.31A 2oxtD-4eviA:
8.8		 2oxtD-4eviA:
21.81
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.
4f85 GERANYL DIPHOSPHATE
2-C-METHYLTRANSFERAS
E

(Streptomyces
lasaliensis) 		PF02353
(CMAS) 		6 ASP A 111
GLY A 113
GLY A 115
GLY A 118
THR A 135
LEU A 136
 None
 0.78A 2oxtD-4f85A:
8.5		 2oxtD-4f85A:
23.12
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.
4g9i HYDROGENASE
MATURATION PROTEIN
HYPF

(Thermococcus
kodakarensis) 		PF00708
(Acylphosphatase)
PF00814
(Peptidase_M22)
PF01300
(Sua5_yciO_yrdC)
PF07503
(zf-HYPF) 		6 GLY A 612
ASP A 746
GLY A 745
GLY A 713
GLY A 510
HIS A 737
 None
ZN  A1003 (-2.4A)
None
ZN  A1003 ( 4.8A)
None
None
 1.28A 2oxtD-4g9iA:
undetectable		 2oxtD-4g9iA:
17.15
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.
4htf S-ADENOSYLMETHIONINE
-DEPENDENT
METHYLTRANSFERASE

(Escherichia
coli) 		PF13847
(Methyltransf_31) 		5 ASP B  50
GLY B  52
GLY B  54
LEU B  74
VAL B 121
 SAM  B 301 ( 4.7A)
SAM  B 301 (-3.5A)
SAM  B 301 (-3.4A)
SAM  B 301 (-4.2A)
SAM  B 301 ( 4.3A)
 0.65A 2oxtD-4htfB:
8.5		 2oxtD-4htfB:
21.52
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.
4iv8 PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE,
PUTATIVE

(Plasmodium
knowlesi) 		PF08241
(Methyltransf_11) 		5 GLY A  38
ASP A  59
GLY A  61
GLY A  63
GLY A  66
 None
SAM  A 301 ( 4.9A)
SAM  A 301 (-3.5A)
SAM  A 301 ( 3.9A)
None
 0.70A 2oxtD-4iv8A:
8.8		 2oxtD-4iv8A:
22.80
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.
4k3j HEPATOCYTE GROWTH
FACTOR

(Homo sapiens) 		PF00089
(Trypsin) 		6 GLY A 618
GLY A 521
GLY A 674
GLY A 671
THR A 531
LEU A 530
 None
 1.47A 2oxtD-4k3jA:
undetectable		 2oxtD-4k3jA:
23.96
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.
4k6m POLYPROTEIN

(Japanese
encephalitis
virus) 		PF00972
(Flavi_NS5)
PF01728
(FtsJ) 		6 ASP A  79
GLY A  81
GLY A  85
HIS A 110
GLU A 111
ASP A 146
 None
SAH  A1001 (-3.3A)
SAH  A1001 (-4.3A)
SAH  A1001 ( 3.6A)
SO4  A1011 (-4.9A)
SAH  A1001 (-3.6A)
 1.10A 2oxtD-4k6mA:
39.5		 2oxtD-4k6mA:
16.36
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.
4k6m POLYPROTEIN

(Japanese
encephalitis
virus) 		PF00972
(Flavi_NS5)
PF01728
(FtsJ) 		9 GLY A  58
ASP A  79
GLY A  81
GLY A  83
GLY A  86
THR A 104
HIS A 110
GLU A 111
ASP A 146
 SAH  A1001 (-3.1A)
None
SAH  A1001 (-3.3A)
SAH  A1001 ( 3.7A)
SAH  A1001 (-3.2A)
SAH  A1001 (-4.7A)
SAH  A1001 ( 3.6A)
SO4  A1011 (-4.9A)
SAH  A1001 (-3.6A)
 0.54A 2oxtD-4k6mA:
39.5		 2oxtD-4k6mA:
16.36
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.
4ls5 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 2

(Bacillus
subtilis) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		6 GLY A 342
GLY A 107
GLY A 109
THR A 165
HIS A 401
HIS A 302
 None
 1.34A 2oxtD-4ls5A:
undetectable		 2oxtD-4ls5A:
21.85
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.
4n49 CAP-SPECIFIC MRNA
(NUCLEOSIDE-2'-O-)-M
ETHYLTRANSFERASE 1

(Homo sapiens) 		PF01728
(FtsJ) 		6 ASP A 275
GLY A 279
GLY A 282
THR A 301
LEU A 302
ASP A 364
 None
SAM  A 601 (-3.5A)
SAM  A 601 (-3.1A)
SAM  A 601 (-4.1A)
SAM  A 601 (-4.1A)
SAM  A 601 (-3.6A)
 0.60A 2oxtD-4n49A:
14.7		 2oxtD-4n49A:
21.89
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.
4rjk ACETOLACTATE
SYNTHASE

(Bacillus
subtilis) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		5 GLY A 103
GLY A  79
GLY A 165
HIS A  32
VAL A  71
 None
 0.82A 2oxtD-4rjkA:
undetectable		 2oxtD-4rjkA:
20.77
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.
4tz5 PUTATIVE SECRETED
PROTEIN

(Streptomyces
sp. SirexAA-E) 		no annotation 6 GLY A  95
ASP A 384
GLY A 420
GLY A 423
GLU A 452
HIS A 481
 None
None
None
None
None
BGC  A 707 (-4.2A)
 1.36A 2oxtD-4tz5A:
undetectable		 2oxtD-4tz5A:
18.46
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.
4zoh PUTATIVE
OXIDOREDUCTASE
MOLYBDOPTERIN-BINDIN
G SUBUNIT

(Sulfurisphaera
tokodaii) 		PF01315
(Ald_Xan_dh_C)
PF02738
(Ald_Xan_dh_C2) 		6 GLY A 440
GLY A 491
GLY A 438
HIS A 663
ASP A 446
VAL A 487
 None
None
None
None
MCN  A 801 (-2.6A)
MCN  A 801 (-3.8A)
 1.38A 2oxtD-4zohA:
undetectable		 2oxtD-4zohA:
17.16
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5e9q GENOME POLYPROTEIN

(Dengue virus) 		PF01728
(FtsJ) 		8 GLY A  58
ASP A  79
GLY A  81
GLY A  83
GLY A  86
THR A 104
HIS A 110
ASP A 146
 SAM  A 301 (-3.2A)
SAM  A 301 ( 4.9A)
SAM  A 301 (-3.3A)
SAM  A 301 (-3.1A)
SAM  A 301 (-3.1A)
SAM  A 301 (-4.6A)
SAM  A 301 ( 3.7A)
SAM  A 301 (-3.8A)
 0.50A 2oxtD-5e9qA:
39.5		 2oxtD-5e9qA:
50.19
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.
5e9w MRNA CAP GUANINE-N7
METHYLTRANSFERASE

(Homo sapiens) 		PF03291
(Pox_MCEL) 		5 ASP A 203
GLY A 205
GLY A 207
GLY A 210
VAL A 286
 SAH  A 500 ( 4.8A)
SAH  A 500 (-3.8A)
SAH  A 500 (-3.5A)
SAH  A 500 ( 4.4A)
SAH  A 500 (-3.8A)
 0.55A 2oxtD-5e9wA:
6.6		 2oxtD-5e9wA:
21.79
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.
5eov 16S/23S RRNA
(CYTIDINE-2'-O)-METH
YLTRANSFERASE TLYA

(Mycobacterium
tuberculosis) 		PF01728
(FtsJ) 		5 GLY A  66
ASP A  88
GLY A  90
GLY A  95
ASP A 154
 None
 0.67A 2oxtD-5eovA:
13.2		 2oxtD-5eovA:
24.79
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.
5f8z PLASMA KALLIKREIN
LIGHT CHAIN

(Homo sapiens) 		PF00089
(Trypsin) 		6 GLY A 142
GLY A  44
GLY A 196
GLY A 193
THR A  54
LEU A  53
 None
 1.39A 2oxtD-5f8zA:
undetectable		 2oxtD-5f8zA:
18.68
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.
5gvt PLASMA KALLIKREIN

(Mus musculus) 		no annotation 6 GLY A 142
GLY A  44
GLY A 196
GLY A 193
THR A  54
LEU A  53
 None
 1.39A 2oxtD-5gvtA:
undetectable		 2oxtD-5gvtA:
undetectable
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5ikm NS5 METHYL
TRANSFERASE

(Dengue virus) 		PF01728
(FtsJ) 		9 GLY A  58
ASP A  79
GLY A  81
GLY A  83
GLY A  86
THR A 104
HIS A 110
GLU A 111
ASP A 146
 SAM  A 311 (-3.3A)
SAM  A 311 ( 4.9A)
SAM  A 311 (-3.2A)
SAM  A 311 (-3.3A)
SAM  A 311 (-3.3A)
SAM  A 311 (-4.5A)
SAM  A 311 (-4.1A)
None
SAM  A 311 (-3.8A)
 0.59A 2oxtD-5ikmA:
38.9		 2oxtD-5ikmA:
49.63
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5ikm NS5 METHYL
TRANSFERASE

(Dengue virus) 		PF01728
(FtsJ) 		6 GLY A  81
GLY A  58
GLY A  86
GLY A  83
THR A  59
ASP A 146
 SAM  A 311 (-3.2A)
SAM  A 311 (-3.3A)
SAM  A 311 (-3.3A)
SAM  A 311 (-3.3A)
None
SAM  A 311 (-3.8A)
 1.39A 2oxtD-5ikmA:
38.9		 2oxtD-5ikmA:
49.63
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.
5jjr GENOME POLYPROTEIN

(Dengue virus) 		PF00972
(Flavi_NS5)
PF01728
(FtsJ) 		8 GLY A  58
ASP A  79
GLY A  81
GLY A  83
GLY A  86
THR A 104
HIS A 110
ASP A 146
 SAH  A1003 (-3.2A)
None
SAH  A1003 (-3.4A)
SAH  A1003 (-3.5A)
SAH  A1003 (-3.0A)
SAH  A1003 (-4.6A)
SAH  A1003 (-3.7A)
SAH  A1003 (-3.8A)
 0.50A 2oxtD-5jjrA:
39.0		 2oxtD-5jjrA:
18.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5jjr GENOME POLYPROTEIN

(Dengue virus) 		PF00972
(Flavi_NS5)
PF01728
(FtsJ) 		6 GLY A  58
ASP A  79
GLY A  83
GLY A  86
THR A 104
GLU A 111
 SAH  A1003 (-3.2A)
None
SAH  A1003 (-3.5A)
SAH  A1003 (-3.0A)
SAH  A1003 (-4.6A)
SAH  A1003 (-3.3A)
 0.98A 2oxtD-5jjrA:
39.0		 2oxtD-5jjrA:
18.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5jr3 CARMINOMYCIN
4-O-METHYLTRANSFERAS
E DNRK

(Streptomyces
peucetius) 		PF00891
(Methyltransf_2) 		5 ASP A 185
GLY A 187
GLY A 189
GLY A 192
VAL A 254
 SAH  A 401 ( 4.7A)
SAH  A 401 (-3.9A)
SAH  A 401 ( 3.8A)
None
SAH  A 401 ( 4.4A)
 0.71A 2oxtD-5jr3A:
8.2		 2oxtD-5jr3A:
22.71
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.
5ms3 KALLIKREIN-8

(Homo sapiens) 		no annotation 6 GLY A 142
GLY A  44
GLY A 196
GLY A 193
THR A  54
LEU A  53
 None
 1.41A 2oxtD-5ms3A:
undetectable		 2oxtD-5ms3A:
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.
5nju GENOME POLYPROTEIN

(Zika virus) 		no annotation 6 ASP A  79
GLY A  81
GLY A  85
HIS A 110
GLU A 111
ASP A 146
 SAH  A1001 ( 4.9A)
SAH  A1001 (-3.4A)
SAH  A1001 ( 4.3A)
SAH  A1001 (-4.0A)
None
SAH  A1001 (-3.7A)
 1.06A 2oxtD-5njuA:
38.8		 2oxtD-5njuA:
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.
5nju GENOME POLYPROTEIN

(Zika virus) 		no annotation 9 GLY A  58
ASP A  79
GLY A  81
GLY A  83
GLY A  86
THR A 104
HIS A 110
GLU A 111
ASP A 146
 SAH  A1001 (-3.3A)
SAH  A1001 ( 4.9A)
SAH  A1001 (-3.4A)
SAH  A1001 (-3.4A)
SAH  A1001 (-3.3A)
SAH  A1001 (-4.4A)
SAH  A1001 (-4.0A)
None
SAH  A1001 (-3.7A)
 0.44A 2oxtD-5njuA:
38.8		 2oxtD-5njuA:
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.
5tmh POLYPROTEIN

(Zika virus) 		PF00972
(Flavi_NS5)
PF01728
(FtsJ) 		9 GLY A  58
ASP A  79
GLY A  81
GLY A  83
GLY A  86
THR A 104
HIS A 110
GLU A 111
ASP A 146
 SAH  A1001 (-3.2A)
None
SAH  A1001 (-3.4A)
SAH  A1001 ( 3.8A)
SAH  A1001 (-3.6A)
SAH  A1001 ( 4.9A)
SAH  A1001 (-3.6A)
None
SAH  A1001 (-3.8A)
 0.69A 2oxtD-5tmhA:
38.4		 2oxtD-5tmhA:
17.08
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.
5to3 PROTHROMBIN,THROMBOM
ODULIN

(Homo sapiens) 		PF00089
(Trypsin)
PF09064
(Tme5_EGF_like) 		6 GLY B 157
GLY B 221
GLY B 218
THR B  55
LEU B  54
VAL B  31
 None
None
0G6  B 501 (-3.9A)
None
None
None
 1.29A 2oxtD-5to3B:
undetectable		 2oxtD-5to3B:
20.33
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.
5ubm COMPLEMENT C1S
SUBCOMPONENT

(Homo sapiens) 		no annotation 6 GLY A 571
GLY A 462
GLY A 633
GLY A 630
THR A 472
LEU A 471
 None
 1.41A 2oxtD-5ubmA:
undetectable		 2oxtD-5ubmA:
22.03
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.
5wp5 PHOSPHOMETHYLETHANOL
AMINE
N-METHYLTRANSFERASE
2

(Arabidopsis
thaliana) 		no annotation 6 GLY A 261
ASP A 288
GLY A 290
GLY A 292
GLY A 294
LEU A 313
 None
SAH  A 501 ( 4.4A)
SAH  A 501 (-3.8A)
SAH  A 501 (-3.6A)
None
SAH  A 501 (-3.9A)
 1.38A 2oxtD-5wp5A:
8.9		 2oxtD-5wp5A:
20.70
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.
5yjp HUMAN CHYMASE

(Homo sapiens) 		no annotation 6 GLY A 142
GLY A  44
GLY A 196
GLY A 193
THR A  54
LEU A  53
 None
None
None
8W6  A 304 ( 4.1A)
None
None
 1.44A 2oxtD-5yjpA:
undetectable		 2oxtD-5yjpA:
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.
5zfh KALLIKREIN-7

(Mus musculus) 		no annotation 6 GLY A 142
GLY A  44
GLY A 196
GLY A 193
THR A  54
LEU A  53
 None
 1.38A 2oxtD-5zfhA:
undetectable		 2oxtD-5zfhA:
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.
6b74 COAGULATION FACTOR
XII

(Homo sapiens) 		no annotation 6 GLY B 142
GLY B  44
GLY B 196
GLY B 193
THR B  54
LEU B  53
 None
None
None
SO4  B 304 (-3.7A)
None
None
 1.45A 2oxtD-6b74B:
undetectable		 2oxtD-6b74B:
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.
6bqc CYCLOPROPANE-FATTY-A
CYL-PHOSPHOLIPID
SYNTHASE

(Escherichia
coli) 		no annotation 5 ASP A 173
GLY A 175
GLY A 177
GLY A 180
THR A 197
 None
 0.75A 2oxtD-6bqcA:
9.1		 2oxtD-6bqcA:
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.
1obb ALPHA-GLUCOSIDASE

(Thermotoga
maritima) 		PF02056
(Glyco_hydro_4)
PF11975
(Glyco_hydro_4C) 		4 SER A 265
TRP A 279
ASP A 222
ILE A 225
 None
 1.44A 2oxtD-1obbA:
4.0		 2oxtD-1obbA:
20.37
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.
1qnl ALIPHATIC AMIDASE
EXPRESSION-REGULATIN
G PROTEIN

(Pseudomonas
aeruginosa) 		PF13433
(Peripla_BP_5) 		4 SER A  26
TRP A 285
ASP A 261
ILE A 260
 None
 1.09A 2oxtD-1qnlA:
1.7		 2oxtD-1qnlA:
21.92
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.
1xr6 GENOME POLYPROTEIN

(Rhinovirus A) 		PF00680
(RdRP_1) 		4 SER A 241
TRP A 246
ASP A 338
ILE A 342
 None
 1.43A 2oxtD-1xr6A:
undetectable		 2oxtD-1xr6A:
18.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1z9z CYTOSKELETON
ASSEMBLY CONTROL
PROTEIN SLA1

(Saccharomyces
cerevisiae) 		PF00018
(SH3_1) 		4 SER A  35
TRP A  38
ASP A  25
ILE A  21
 None
 1.42A 2oxtD-1z9zA:
undetectable		 2oxtD-1z9zA:
11.86
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.
2amg 1,4-ALPHA-D-GLUCAN
MALTOTETRAHYDROLASE

(Pseudomonas
stutzeri) 		PF00128
(Alpha-amylase)
PF09081
(DUF1921) 		4 SER A 210
TRP A 206
ASP A  82
ILE A 127
 None
 1.49A 2oxtD-2amgA:
0.0		 2oxtD-2amgA:
21.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2oxt NUCLEOSIDE-2'-O-METH
YLTRANSFERASE

(Meaban virus) 		PF01728
(FtsJ) 		4 SER A  57
TRP A  88
ASP A 132
ILE A 133
 SAM  A 300 (-2.6A)
SAM  A 300 (-3.8A)
SAM  A 300 (-3.9A)
SAM  A 300 (-3.8A)
 0.18A 2oxtD-2oxtA:
45.2		 2oxtD-2oxtA:
100.00
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.
3cmm UBIQUITIN-ACTIVATING
ENZYME E1 1

(Saccharomyces
cerevisiae) 		PF00899
(ThiF)
PF09358
(E1_UFD)
PF10585
(UBA_e1_thiolCys)
PF16190
(E1_FCCH)
PF16191
(E1_4HB) 		4 SER A 664
TRP A 675
ASP A 763
ILE A 762
 None
 1.35A 2oxtD-3cmmA:
3.6		 2oxtD-3cmmA:
14.30
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3evc RNA-DIRECTED RNA
POLYMERASE NS5

(Yellow fever
virus) 		PF01728
(FtsJ) 		4 SER A  56
TRP A  87
ASP A 131
ILE A 132
 SAH  A 901 (-2.6A)
SAH  A 901 (-3.6A)
SAH  A 901 (-3.7A)
SAH  A 901 (-3.8A)
 0.39A 2oxtD-3evcA:
39.8		 2oxtD-3evcA:
48.89
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.
3u7v BETA-GALACTOSIDASE

(Caulobacter
vibrioides) 		PF02449
(Glyco_hydro_42) 		4 SER A 295
TRP A 130
ASP A 315
ILE A 314
 None
 1.49A 2oxtD-3u7vA:
0.2		 2oxtD-3u7vA:
19.37
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.
3uyw HEMAGGLUTININ

(Influenza A
virus) 		PF00509
(Hemagglutinin) 		4 SER A 127
TRP A 129
ASP A 244
ILE A 246
 None
 1.34A 2oxtD-3uywA:
0.0		 2oxtD-3uywA:
23.16
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.
4d1i BETA-GALACTOSIDASE,
PUTATIVE, BGL35A

(Cellvibrio
japonicus) 		PF02449
(Glyco_hydro_42) 		4 SER A 297
TRP A 133
ASP A 317
ILE A 316
 None
 1.47A 2oxtD-4d1iA:
undetectable		 2oxtD-4d1iA:
19.06
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.
4jpk GERMLINE-TARGETING
HIV-1 GP120
ENGINEERED OUTER
DOMAIN, EOD-GT6

(Human
immunodeficiency
virus 1) 		PF00516
(GP120) 		4 SER A 166
TRP A 112
ASP A  47
ILE A  23
 None
 1.42A 2oxtD-4jpkA:
undetectable		 2oxtD-4jpkA:
20.72
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.
4jtv HEMAGGLUTININ

(Influenza A
virus) 		PF00509
(Hemagglutinin) 		4 SER A 127
TRP A 129
ASP A 244
ILE A 246
 None
 1.34A 2oxtD-4jtvA:
undetectable		 2oxtD-4jtvA:
21.62
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.
4jug HEMAGGLUTININ

(Influenza A
virus) 		PF00509
(Hemagglutinin) 		4 SER A 125
TRP A 127
ASP A 241
ILE A 243
 None
 1.28A 2oxtD-4jugA:
undetectable		 2oxtD-4jugA:
21.19
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.
4ptx GLYCOSIDE HYDROLASE
FAMILY 1

(Halothermothrix
orenii) 		PF00232
(Glyco_hydro_1) 		4 SER A  79
TRP A 122
ASP A  49
ILE A  45
 None
 1.42A 2oxtD-4ptxA:
undetectable		 2oxtD-4ptxA:
20.26
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.
4r4h HIV-1 ENV GP120

(Human
immunodeficiency
virus 1) 		PF00516
(GP120) 		4 SER A 392
TRP A 338
ASP A 269
ILE A 270
 None
 1.38A 2oxtD-4r4hA:
undetectable		 2oxtD-4r4hA:
20.75
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.
4zaj ARGININE--TRNA
LIGASE, CYTOPLASMIC

(Homo sapiens) 		PF00750
(tRNA-synt_1d)
PF03485
(Arg_tRNA_synt_N)
PF05746
(DALR_1) 		4 SER A 100
TRP A 561
ASP A 479
ILE A 478
 None
 1.11A 2oxtD-4zajA:
2.5		 2oxtD-4zajA:
18.46
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.
5hct ENDOTHIAPEPSIN

(Cryphonectria
parasitica) 		PF00026
(Asp) 		4 SER A  38
TRP A  42
ASP A  11
ILE A  10
 None
 1.30A 2oxtD-5hctA:
undetectable		 2oxtD-5hctA:
20.14
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.
5k9o HEMAGGLUTININ

(Influenza A
virus) 		PF00509
(Hemagglutinin) 		4 SER F 125
TRP F 127
ASP F 241
ILE F 243
 None
 1.27A 2oxtD-5k9oF:
undetectable		 2oxtD-5k9oF:
17.19
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.
5nlm INDOXYL
UDP-GLUCOSYLTRANSFER
ASE

(Persicaria
tinctoria) 		no annotation 4 SER A 475
TRP A 473
ASP A 130
ILE A 129
 None
 1.48A 2oxtD-5nlmA:
undetectable		 2oxtD-5nlmA:
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.
5p60 ENDOTHIAPEPSIN

(Cryphonectria
parasitica) 		PF00026
(Asp) 		4 SER A  38
TRP A  42
ASP A  11
ILE A  10
 None
 1.30A 2oxtD-5p60A:
undetectable		 2oxtD-5p60A:
22.56
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.
5w6t HEMAGGLUTININ

(Influenza A
virus) 		PF00509
(Hemagglutinin) 		4 SER A 125
TRP A 127
ASP A 241
ILE A 243
 None
 1.46A 2oxtD-5w6tA:
undetectable		 2oxtD-5w6tA:
21.02