SIMILAR PATTERNS OF AMINO ACIDS FOR 1UDT_A_VIAA1000

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.
13pk 3-PHOSPHOGLYCERATE
KINASE

(Trypanosoma
brucei) 		PF00162
(PGK) 		5 HIS A  62
ALA A 175
ILE A 180
VAL A 134
LEU A 130
 3PG  A 423 (-4.1A)
None
None
None
None
 1.04A 1udtA-13pkA:
undetectable		 1udtA-13pkA:
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.
1bu8 PROTEIN (PANCREATIC
LIPASE RELATED
PROTEIN 2)

(Rattus
norvegicus) 		PF00151
(Lipase)
PF01477
(PLAT) 		5 ALA A 129
ILE A 128
VAL A 169
ALA A 196
PHE A  72
 None
 1.22A 1udtA-1bu8A:
undetectable		 1udtA-1bu8A:
20.43
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.
1g67 THIAMIN PHOSPHATE
SYNTHASE

(Bacillus
subtilis) 		PF02581
(TMP-TENI) 		5 TYR A 147
ALA A 194
ILE A 189
ALA A  53
LEU A  55
 None
 1.33A 1udtA-1g67A:
undetectable		 1udtA-1g67A:
22.92
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.
1gyt CYTOSOL
AMINOPEPTIDASE

(Escherichia
coli) 		PF00883
(Peptidase_M17)
PF02789
(Peptidase_M17_N) 		5 TYR A 202
VAL A 300
ALA A 299
LEU A 190
MET A 294
 None
 1.30A 1udtA-1gytA:
undetectable		 1udtA-1gytA:
22.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1hw2 FATTY ACID
METABOLISM REGULATOR
PROTEIN

(Escherichia
coli) 		PF00392
(GntR)
PF07840
(FadR_C) 		5 ALA A 116
ILE A 113
VAL A 127
ALA A 129
LEU A 144
 None
 1.29A 1udtA-1hw2A:
undetectable		 1udtA-1hw2A:
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.
1iom CITRATE SYNTHASE

(Thermus
thermophilus) 		PF00285
(Citrate_synt) 		5 HIS A 153
ALA A 133
VAL A 335
ALA A 334
PHE A 324
 None
 1.32A 1udtA-1iomA:
0.7		 1udtA-1iomA:
20.97
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.
1k0f PERIPLASMIC
ZINC-BINDING PROTEIN
TROA

(Treponema
pallidum) 		PF01297
(ZnuA) 		5 TYR A 204
ALA A  46
VAL A 113
ALA A 112
LEU A  91
 None
 1.20A 1udtA-1k0fA:
undetectable		 1udtA-1k0fA:
20.76
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.
1m39 CALTRACTIN, ISOFORM
1

(Homo sapiens) 		PF13499
(EF-hand_7) 		5 ILE A 121
VAL A 129
ALA A 130
MET A 145
PHE A  86
 None
 1.32A 1udtA-1m39A:
undetectable		 1udtA-1m39A:
16.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1n9b BETA-LACTAMASE SHV-2

(Klebsiella
pneumoniae) 		PF13354
(Beta-lactamase2) 		5 ALA A 126
ILE A 127
VAL A  80
ALA A  79
LEU A 199
 None
 1.30A 1udtA-1n9bA:
undetectable		 1udtA-1n9bA:
23.10
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.
1qju PROTEIN VP1

(Rhinovirus A) 		PF00073
(Rhv) 		5 TYR 1  88
ALA 1 159
LEU 1  82
MET 1 140
GLN 1 141
 None
 1.18A 1udtA-1qju1:
undetectable		 1udtA-1qju1:
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.
1ru3 ACETYL-COA SYNTHASE

(Carboxydothermus
hydrogenoformans) 		PF03598
(CdhC) 		5 TYR A 543
ASN A 546
ALA A 541
MET A 398
GLN A 399
 None
 1.28A 1udtA-1ru3A:
undetectable		 1udtA-1ru3A:
18.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1spg HEMOGLOBIN

(Leiostomus
xanthurus) 		PF00042
(Globin) 		5 HIS B  63
ALA B  27
ILE B 109
VAL B  67
LEU B 142
 CMO  B 149 ( 3.9A)
None
None
HEM  B 148 (-3.9A)
HEM  B 148 (-4.9A)
 1.29A 1udtA-1spgB:
undetectable		 1udtA-1spgB:
17.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1tdj BIOSYNTHETIC
THREONINE DEAMINASE

(Escherichia
coli) 		PF00291
(PALP)
PF00585
(Thr_dehydrat_C) 		5 TYR A  16
ALA A 197
LEU A 192
GLN A 256
PHE A 252
 None
None
PLP  A 962 (-4.5A)
None
None
 1.27A 1udtA-1tdjA:
undetectable		 1udtA-1tdjA:
21.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1toa PROTEIN (PERIPLASMIC
BINDING PROTEIN
TROA)

(Treponema
pallidum) 		PF01297
(ZnuA) 		5 TYR A 204
ALA A  46
VAL A 113
ALA A 112
LEU A  91
 None
 1.28A 1udtA-1toaA:
undetectable		 1udtA-1toaA:
21.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1tvp CELLULASE

(Pseudoalteromonas
haloplanktis) 		PF00150
(Cellulase) 		5 ALA A  90
ILE A  89
VAL A  44
ALA A  47
LEU A  26
 None
 1.23A 1udtA-1tvpA:
undetectable		 1udtA-1tvpA:
19.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1w7c LYSYL OXIDASE

(Komagataella
pastoris) 		PF01179
(Cu_amine_oxid)
PF02727
(Cu_amine_oxidN2)
PF09248
(DUF1965) 		5 ASN A 661
TYR A 664
ALA A 382
ALA A 215
LEU A 219
 None
None
TPQ  A 478 ( 4.6A)
None
None
 1.14A 1udtA-1w7cA:
undetectable		 1udtA-1w7cA:
17.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1zan FAB AD11 HEAVY CHAIN
FAB AD11 LIGHT CHAIN

(Rattus
norvegicus) 		PF07654
(C1-set)
PF07686
(V-set) 		5 TYR L  71
ALA L  25
ILE L   2
ALA L  34
LEU H 100
 None
 1.11A 1udtA-1zanL:
undetectable		 1udtA-1zanL:
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.
1zkl HIGH-AFFINITY
CAMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE 7A

(Homo sapiens) 		PF00233
(PDEase_I) 		6 TYR A 211
HIS A 212
VAL A 380
LEU A 401
GLN A 413
PHE A 416
 IBM  A 503 (-4.6A)
None
IBM  A 503 (-4.7A)
None
IBM  A 503 (-3.0A)
IBM  A 503 (-3.4A)
 0.79A 1udtA-1zklA:
35.3		 1udtA-1zklA:
28.80
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.
2a7n L(+)-MANDELATE
DEHYDROGENASE

(Pseudomonas
putida;
Spinacia
oleracea) 		PF01070
(FMN_dh) 		5 TYR A 150
ALA A 101
ILE A 103
ALA A  93
LEU A 118
 None
 1.26A 1udtA-2a7nA:
undetectable		 1udtA-2a7nA:
19.12
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.
2a81 CARB

(Pectobacterium
carotovorum) 		PF00378
(ECH_1) 		5 ASN A 211
ALA A  99
VAL A  90
ALA A  89
LEU A 218
 None
 1.23A 1udtA-2a81A:
undetectable		 1udtA-2a81A:
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.
2dch PUTATIVE HOMING
ENDONUCLEASE

(Thermoproteus) 		PF14528
(LAGLIDADG_3) 		5 TYR X   6
ALA X 140
ILE X 139
ALA X 168
LEU X 175
 None
 1.32A 1udtA-2dchX:
undetectable		 1udtA-2dchX:
19.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2dw1 CATROCOLLASTATIN

(Crotalus atrox) 		PF00200
(Disintegrin)
PF01421
(Reprolysin)
PF08516
(ADAM_CR) 		5 ASN A 286
ILE A 235
VAL A 243
ALA A 244
LEU A 204
 None
 1.32A 1udtA-2dw1A:
undetectable		 1udtA-2dw1A:
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.
2f2b AQUAPORIN AQPM

(Methanothermobacter
marburgensis) 		PF00230
(MIP) 		5 ALA A  67
ILE A  66
ALA A 165
LEU A  89
MET A 158
 None
GOL  A 501 (-3.9A)
None
None
None
 1.32A 1udtA-2f2bA:
undetectable		 1udtA-2f2bA:
21.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2gfp MULTIDRUG RESISTANCE
PROTEIN D

(Escherichia
coli) 		PF07690
(MFS_1) 		5 TYR A 165
TYR A  52
ILE A  76
VAL A  19
ALA A  18
 None
 1.04A 1udtA-2gfpA:
undetectable		 1udtA-2gfpA:
20.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2hau SEROTRANSFERRIN

(Homo sapiens) 		PF00405
(Transferrin) 		5 ASN A 268
ALA A  59
VAL A  81
ALA A  82
PHE A 295
 None
 1.33A 1udtA-2hauA:
undetectable		 1udtA-2hauA:
18.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2i4c BICARBONATE
TRANSPORTER

(Synechocystis
sp. PCC 6803) 		PF13379
(NMT1_2) 		5 ASN A 166
ILE A 217
VAL A 156
ALA A 155
PHE A 206
 None
 1.29A 1udtA-2i4cA:
undetectable		 1udtA-2i4cA:
20.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2np0 BOTULINUM NEUROTOXIN
TYPE B

(Clostridium
botulinum) 		PF01742
(Peptidase_M27)
PF07951
(Toxin_R_bind_C)
PF07952
(Toxin_trans)
PF07953
(Toxin_R_bind_N) 		5 TYR A 622
ALA A 766
ILE A 767
VAL A 620
LEU A 650
 None
 1.16A 1udtA-2np0A:
undetectable		 1udtA-2np0A:
13.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2nv2 PYRIDOXAL
BIOSYNTHESIS LYASE
PDXS

(Bacillus
subtilis) 		PF01680
(SOR_SNZ) 		5 ASN A  27
ALA A  39
ILE A  76
VAL A  25
ALA A  44
 None
 1.32A 1udtA-2nv2A:
undetectable		 1udtA-2nv2A:
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.
2q7s N-FORMYLGLUTAMATE
AMIDOHYDROLASE

(Cupriavidus
pinatubonensis) 		PF05013
(FGase) 		5 HIS A 171
ASN A 169
ILE A  81
ALA A  73
LEU A 151
 ZN  A 400 (-3.0A)
None
None
None
None
 1.17A 1udtA-2q7sA:
undetectable		 1udtA-2q7sA:
21.87
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.
2qsf DNA REPAIR PROTEIN
RAD4

(Saccharomyces
cerevisiae) 		PF03835
(Rad4)
PF10403
(BHD_1)
PF10405
(BHD_3) 		5 ALA A 271
ILE A 162
VAL A 255
LEU A 246
GLN A 267
 None
 1.33A 1udtA-2qsfA:
undetectable		 1udtA-2qsfA:
20.58
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2r8q CLASS I
PHOSPHODIESTERASE
PDEB1

(Leishmania
major) 		PF00233
(PDEase_I) 		5 TYR A 680
HIS A 681
VAL A 853
GLN A 887
PHE A 890
 IBM  A   3 ( 4.7A)
IBM  A   3 ( 4.8A)
IBM  A   3 ( 4.8A)
IBM  A   3 (-3.3A)
IBM  A   3 (-3.6A)
 0.52A 1udtA-2r8qA:
38.2		 1udtA-2r8qA:
30.92
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.
2vd3 ATP
PHOSPHORIBOSYLTRANSF
ERASE

(Methanothermobacter
thermautotrophicus) 		PF01634
(HisG)
PF08029
(HisG_C) 		5 ALA A 147
ILE A 156
VAL A 115
ALA A 114
LEU A 128
 None
None
MRD  A1299 ( 4.4A)
None
None
 1.31A 1udtA-2vd3A:
undetectable		 1udtA-2vd3A:
23.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2xhl BOTULINUM NEUROTOXIN
B HEAVY CHAIN

(Clostridium
botulinum) 		PF07952
(Toxin_trans) 		5 TYR B 638
ALA B 782
ILE B 783
VAL B 636
LEU B 666
 None
 1.08A 1udtA-2xhlB:
undetectable		 1udtA-2xhlB:
20.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2yxd PROBABLE
COBALT-PRECORRIN-6Y
C(15)-METHYLTRANSFER
ASE
[DECARBOXYLATING]

(Methanocaldococcus
jannaschii) 		PF13847
(Methyltransf_31) 		5 ALA A  92
ILE A  63
ALA A 129
LEU A  31
MET A  49
 None
 1.33A 1udtA-2yxdA:
undetectable		 1udtA-2yxdA:
17.59
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.
3at6 BETA-GLOBIN

(Podocnemis
unifilis) 		PF00042
(Globin) 		5 HIS B  63
ALA B  27
ILE B 109
VAL B  67
LEU B 141
 HEM  B 147 (-4.6A)
None
None
HEM  B 147 ( 3.9A)
HEM  B 147 (-4.7A)
 1.27A 1udtA-3at6B:
undetectable		 1udtA-3at6B:
20.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3b2r CGMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE

(Homo sapiens) 		PF00233
(PDEase_I) 		9 TYR A 612
HIS A 613
ALA A 767
ILE A 768
VAL A 782
ALA A 783
MET A 816
GLN A 817
PHE A 820
 VDN  A   1 (-4.8A)
VDN  A   1 (-4.3A)
VDN  A   1 ( 3.8A)
VDN  A   1 (-4.5A)
VDN  A   1 ( 4.7A)
VDN  A   1 ( 4.0A)
VDN  A   1 (-4.0A)
VDN  A   1 (-3.0A)
VDN  A   1 (-3.6A)
 0.36A 1udtA-3b2rA:
46.1		 1udtA-3b2rA:
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.
3bc9 ALPHA AMYLASE,
CATALYTIC REGION

(Halothermothrix
orenii) 		PF00128
(Alpha-amylase)
PF09154
(DUF1939) 		5 ALA A 214
ILE A 215
VAL A 167
ALA A 166
PHE A 344
 None
 1.09A 1udtA-3bc9A:
undetectable		 1udtA-3bc9A:
19.13
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3bjc CGMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE

(Homo sapiens) 		PF00233
(PDEase_I) 		8 TYR A 612
HIS A 613
ALA A 767
ILE A 768
VAL A 782
ALA A 783
GLN A 817
PHE A 820
 None
MG  A 877 (-4.4A)
WAN  A 901 ( 3.9A)
WAN  A 901 ( 4.9A)
WAN  A 901 ( 4.9A)
WAN  A 901 (-3.6A)
WAN  A 901 (-3.1A)
WAN  A 901 (-3.7A)
 0.34A 1udtA-3bjcA:
47.8		 1udtA-3bjcA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3bjc CGMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE

(Homo sapiens) 		PF00233
(PDEase_I) 		8 TYR A 612
HIS A 613
ALA A 767
ILE A 768
VAL A 782
MET A 816
GLN A 817
PHE A 820
 None
MG  A 877 (-4.4A)
WAN  A 901 ( 3.9A)
WAN  A 901 ( 4.9A)
WAN  A 901 ( 4.9A)
WAN  A 901 (-4.3A)
WAN  A 901 (-3.1A)
WAN  A 901 (-3.7A)
 0.61A 1udtA-3bjcA:
47.8		 1udtA-3bjcA:
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.
3brs PERIPLASMIC BINDING
PROTEIN/LACI
TRANSCRIPTIONAL
REGULATOR

(Lachnoclostridium
phytofermentans) 		PF13407
(Peripla_BP_4) 		5 TYR A 200
ALA A 110
ILE A 249
ALA A  73
PHE A  21
 None
 1.33A 1udtA-3brsA:
undetectable		 1udtA-3brsA:
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.
3c1o EUGENOL SYNTHASE

(Clarkia breweri) 		PF05368
(NmrA) 		5 ALA A 137
ILE A 138
ALA A  99
LEU A  72
PHE A 106
 None
 1.12A 1udtA-3c1oA:
undetectable		 1udtA-3c1oA:
22.07
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.
3dhv D-ALANINE-POLY(PHOSP
HORIBITOL) LIGASE

(Bacillus cereus) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		5 TYR A 440
ALA A 461
ILE A 462
MET A 480
PHE A 479
 None
 1.22A 1udtA-3dhvA:
undetectable		 1udtA-3dhvA:
18.62
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.
3ecn HIGH AFFINITY
CAMP-SPECIFIC AND
IBMX-INSENSITIVE
3',5'-CYCLIC
PHOSPHODIESTERASE 8A

(Homo sapiens) 		PF00233
(PDEase_I) 		5 TYR A 555
HIS A 556
ALA A 742
GLN A 778
PHE A 781
 None
None
None
IBM  A   3 (-3.4A)
IBM  A   3 (-3.5A)
 1.25A 1udtA-3ecnA:
35.2		 1udtA-3ecnA:
26.26
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.
3geu INTERCELLULAR
ADHESION PROTEIN R

(Staphylococcus
aureus) 		PF00440
(TetR_N) 		5 TYR A  48
TYR A 153
VAL A  52
LEU A  59
GLN A 113
 None
 1.20A 1udtA-3geuA:
undetectable		 1udtA-3geuA:
23.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3im9 MALONYL COA-ACYL
CARRIER PROTEIN
TRANSACYLASE

(Staphylococcus
aureus) 		PF00698
(Acyl_transf_1) 		5 ASN A 229
TYR A 250
ALA A 107
ILE A 110
PHE A 210
 None
None
None
None
CA  A 601 ( 4.9A)
 1.24A 1udtA-3im9A:
undetectable		 1udtA-3im9A:
23.85
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.
3jcl SPIKE GLYCOPROTEIN

(Murine
coronavirus) 		PF01601
(Corona_S2)
PF09408
(Spike_rec_bind)
PF16451
(Spike_NTD) 		5 TYR A  51
ILE A 126
VAL A 260
LEU A 263
PHE A 206
 None
 1.26A 1udtA-3jclA:
undetectable		 1udtA-3jclA:
13.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3jcl SPIKE GLYCOPROTEIN

(Murine
coronavirus) 		PF01601
(Corona_S2)
PF09408
(Spike_rec_bind)
PF16451
(Spike_NTD) 		5 TYR A 258
TYR A  51
ILE A 141
LEU A 263
PHE A 206
 None
 1.33A 1udtA-3jclA:
undetectable		 1udtA-3jclA:
13.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3kfw UNCHARACTERIZED
PROTEIN

(Mycobacterium
tuberculosis) 		PF07848
(PaaX)
PF08223
(PaaX_C) 		5 TYR X  61
ALA X 233
ALA X  32
LEU X  41
GLN X  29
 None
 1.15A 1udtA-3kfwX:
undetectable		 1udtA-3kfwX:
21.33
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.
3kws PUTATIVE SUGAR
ISOMERASE

(Parabacteroides
distasonis) 		PF01261
(AP_endonuc_2) 		5 ALA A  60
ILE A  59
VAL A  77
LEU A  51
PHE A 286
 None
 1.04A 1udtA-3kwsA:
undetectable		 1udtA-3kwsA:
21.35
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.
3lpd ACIDIC EXTRACELLULAR
SUBTILISIN-LIKE
PROTEASE APRV2

(Dichelobacter
nodosus) 		PF00082
(Peptidase_S8) 		5 ALA A 287
ILE A 291
VAL A  37
ALA A  38
LEU A  55
 None
 1.19A 1udtA-3lpdA:
undetectable		 1udtA-3lpdA:
19.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3nrn UNCHARACTERIZED
PROTEIN PF1083

(Pyrococcus
furiosus) 		PF01593
(Amino_oxidase) 		5 ILE A 340
VAL A 276
ALA A 275
MET A 316
PHE A 297
 None
 1.15A 1udtA-3nrnA:
undetectable		 1udtA-3nrnA:
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.
3p1u SUSD HOMOLOG

(Parabacteroides
distasonis) 		PF12741
(SusD-like) 		5 ALA A 233
ILE A 230
ALA A 387
LEU A 449
PHE A 394
 None
 1.29A 1udtA-3p1uA:
undetectable		 1udtA-3p1uA:
20.19
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.
3qr3 ENDOGLUCANASE EG-II

(Trichoderma
reesei) 		PF00150
(Cellulase) 		5 TYR A  28
ALA A  10
LEU A  88
MET A  47
GLN A  46
 None
 1.19A 1udtA-3qr3A:
undetectable		 1udtA-3qr3A:
19.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3svi TYPE III EFFECTOR
HOPAB2

(Pseudomonas
syringae group
genomosp. 3) 		no annotation 5 ALA A 211
ALA A 158
LEU A 178
MET A 166
PHE A 167
 None
 1.14A 1udtA-3sviA:
undetectable		 1udtA-3sviA:
14.87
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.
3t7z NUCLEOLAR PROTEIN
NOP 56/58

(Methanocaldococcus
jannaschii) 		no annotation 5 TYR A   9
ALA A  52
ILE A  51
LEU A  79
PHE A   6
 None
 1.23A 1udtA-3t7zA:
undetectable		 1udtA-3t7zA:
16.93
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.
3tjy EFFECTOR PROTEIN
HOPAB3

(Pseudomonas
syringae group
genomosp. 3) 		no annotation 5 ALA A 211
ALA A 158
LEU A 178
MET A 166
PHE A 167
 None
 1.16A 1udtA-3tjyA:
undetectable		 1udtA-3tjyA:
14.51
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.
3u24 PUTATIVE LIPOPROTEIN

(Shewanella
oneidensis) 		PF05960
(DUF885) 		5 ASN A 195
ALA A 175
ILE A  75
ALA A 233
MET A 166
 None
None
CA  A 607 ( 4.8A)
None
None
 1.32A 1udtA-3u24A:
undetectable		 1udtA-3u24A:
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.
3u4y UNCHARACTERIZED
PROTEIN

(Desulfotomaculum
acetoxidans) 		PF10282
(Lactonase) 		5 ALA A 127
ILE A 123
ALA A 131
LEU A 139
PHE A 153
 None
 1.10A 1udtA-3u4yA:
undetectable		 1udtA-3u4yA:
23.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3v1v 2-METHYLISOBORNEOL
SYNTHASE

(Streptomyces
coelicolor) 		no annotation 5 ALA A 221
ILE A 222
VAL A 196
ALA A 195
MET A 190
 None
None
None
None
GST  A 511 (-3.0A)
 1.31A 1udtA-3v1vA:
undetectable		 1udtA-3v1vA:
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.
3wfo POLY A POLYMERASE

(Aquifex
aeolicus) 		PF01743
(PolyA_pol)
PF01966
(HD)
PF12627
(PolyA_pol_RNAbd) 		5 ALA A 193
ILE A 192
VAL A 239
ALA A 236
LEU A 227
 None
 1.10A 1udtA-3wfoA:
8.3		 1udtA-3wfoA:
21.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3zdj ENCA BETA-LACTAMASE

(synthetic
construct) 		PF13354
(Beta-lactamase2) 		5 ALA A 126
ILE A 127
VAL A  80
ALA A  79
LEU A 199
 None
 1.32A 1udtA-3zdjA:
undetectable		 1udtA-3zdjA:
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.
3zuq BOTULINUM NEUROTOXIN
TYPE B

(Clostridium
botulinum) 		PF01742
(Peptidase_M27)
PF07952
(Toxin_trans) 		5 TYR A 658
ALA A 802
ILE A 803
VAL A 656
LEU A 686
 None
 1.17A 1udtA-3zuqA:
undetectable		 1udtA-3zuqA:
16.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4a9a RIBOSOME-INTERACTING
GTPASE 1

(Saccharomyces
cerevisiae) 		PF01926
(MMR_HSR1)
PF02824
(TGS)
PF16897
(MMR_HSR1_Xtn) 		5 TYR A 213
ALA A  36
VAL A 209
ALA A 208
LEU A 201
 None
 1.06A 1udtA-4a9aA:
undetectable		 1udtA-4a9aA:
21.67
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.
4awn DEOXYRIBONUCLEASE-1

(Homo sapiens) 		PF03372
(Exo_endo_phos) 		5 TYR A 151
ALA A 230
ILE A 214
VAL A 225
ALA A 224
 None
 1.17A 1udtA-4awnA:
undetectable		 1udtA-4awnA:
21.43
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4i15 CLASS 1
PHOSPHODIESTERASE
PDEB1

(Trypanosoma
brucei) 		PF00233
(PDEase_I) 		5 TYR A 668
HIS A 669
VAL A 840
GLN A 874
PHE A 877
 None
 0.67A 1udtA-4i15A:
37.2		 1udtA-4i15A:
31.77
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.
4ifp MALTOSE-BINDING
PERIPLASMIC
PROTEIN,NACHT, LRR
AND PYD
DOMAINS-CONTAINING
PROTEIN 1

(Escherichia
coli;
Homo sapiens) 		PF00619
(CARD)
PF13416
(SBP_bac_8) 		5 HIS A 445
ILE A 383
VAL A 389
LEU A 396
PHE A 423
 MLI  A 502 (-4.1A)
None
None
None
None
 1.32A 1udtA-4ifpA:
undetectable		 1udtA-4ifpA:
20.67
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.
4mf9 HEMIN DEGRADING
FACTOR

(Pseudomonas
aeruginosa) 		PF05171
(HemS) 		5 TYR A  90
ALA A 125
ILE A 124
VAL A 164
LEU A  63
 None
 1.32A 1udtA-4mf9A:
undetectable		 1udtA-4mf9A:
22.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4mm1 GERANYLGERANYLGLYCER
YL PHOSPHATE
SYNTHASE

(Methanothermobacter
thermautotrophicus) 		PF01884
(PcrB) 		5 TYR A 105
ALA A 125
ILE A  93
ALA A 116
LEU A 113
 None
 1.24A 1udtA-4mm1A:
undetectable		 1udtA-4mm1A:
18.90
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.
4mmo SSO-CP2
METALLO-CARBOXYPETID
ASE

(Sulfolobus
solfataricus) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		5 TYR A 405
ILE A 424
VAL A 366
ALA A 363
LEU A 167
 None
 1.34A 1udtA-4mmoA:
undetectable		 1udtA-4mmoA:
21.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4mzd NISIN LEADER
PEPTIDE-PROCESSING
SERINE PROTEASE NISP

(Lactococcus
lactis) 		PF00082
(Peptidase_S8) 		5 ALA A 471
ILE A 450
VAL A 447
ALA A 446
LEU A 541
 None
 1.23A 1udtA-4mzdA:
undetectable		 1udtA-4mzdA:
20.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4nc2 B39 VHH

(Lama glama) 		PF07686
(V-set) 		5 TYR B 109
ALA B  50
ILE B  51
LEU B  27
GLN B  78
 None
 1.24A 1udtA-4nc2B:
undetectable		 1udtA-4nc2B:
13.89
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.
4ptf DNA POLYMERASE
EPSILON CATALYTIC
SUBUNIT A

(Saccharomyces
cerevisiae) 		PF00136
(DNA_pol_B)
PF03104
(DNA_pol_B_exo1) 		5 TYR A 525
TYR A 245
ILE A 170
ALA A 524
PHE A 140
 None
 1.27A 1udtA-4ptfA:
undetectable		 1udtA-4ptfA:
14.26
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.
4toq CLASS III CHITINASE

(Punica granatum) 		PF00704
(Glyco_hydro_18) 		5 TYR A  99
ALA A 149
VAL A 118
ALA A 117
MET A  76
 None
 1.14A 1udtA-4toqA:
undetectable		 1udtA-4toqA:
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.
4twl DIOSCORIN 5

(Dioscorea
japonica) 		PF00194
(Carb_anhydrase) 		5 ALA A 113
ILE A 129
VAL A 202
ALA A 136
GLN A 169
 None
 1.24A 1udtA-4twlA:
undetectable		 1udtA-4twlA:
20.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4tx8 PROBABLE CHITINASE A

(Chromobacterium
violaceum) 		PF00704
(Glyco_hydro_18) 		5 ASN A 272
ILE A 255
VAL A 267
LEU A 275
MET A 299
 FLC  A 504 ( 4.1A)
None
None
None
None
 1.33A 1udtA-4tx8A:
undetectable		 1udtA-4tx8A:
19.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4uqm URACIL-DNA
GLYCOSYLASE

(Deinococcus
radiodurans) 		PF03167
(UDG) 		5 TYR A 112
VAL A 138
ALA A 134
LEU A 130
GLN A 136
 None
 1.18A 1udtA-4uqmA:
undetectable		 1udtA-4uqmA:
21.96
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.
4wxz PYRIDOXAL
BIOSYNTHESIS LYASE
PDXS

(Geobacillus
kaustophilus) 		PF01680
(SOR_SNZ) 		5 ASN A  27
ALA A  39
ILE A  76
VAL A  25
ALA A  44
 None
 1.26A 1udtA-4wxzA:
undetectable		 1udtA-4wxzA:
19.10
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.
4xvx ACYL-[ACYL-CARRIER-P
ROTEIN]
DEHYDROGENASE MBTN

(Mycobacterium
tuberculosis) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N) 		5 ALA A 120
ILE A 118
VAL A 181
ALA A 221
LEU A 102
 FDA  A 402 (-3.3A)
FDA  A 402 (-4.9A)
None
None
None
 0.99A 1udtA-4xvxA:
undetectable		 1udtA-4xvxA:
21.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5a3y THERMOLYSIN

(Bacillus
thermoproteolyticus) 		PF01447
(Peptidase_M4)
PF02868
(Peptidase_M4_C) 		5 ALA A 309
ILE A 244
ALA A 286
LEU A 275
PHE A 267
 None
 1.03A 1udtA-5a3yA:
undetectable		 1udtA-5a3yA:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5a9g MANGANESE SUPEROXIDE
DISMUTASE

(Sphingobacterium
spiritivorum) 		PF00081
(Sod_Fe_N)
PF02777
(Sod_Fe_C) 		5 TYR A  62
ILE A  52
VAL A  66
ALA A  65
PHE A   2
 None
 1.24A 1udtA-5a9gA:
undetectable		 1udtA-5a9gA:
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.
5b58 PUTATIVE HEMIN ABC
TRANSPORT SYSTEM,
MEMBRANE PROTEIN

(Burkholderia
cenocepacia) 		PF01032
(FecCD) 		5 ALA A 182
ILE A 181
VAL A 161
ALA A 158
LEU A 268
 None
 1.13A 1udtA-5b58A:
undetectable		 1udtA-5b58A:
20.15
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.
5c3m PUTATIVE
6-PHOSPHO-BETA-GLUCO
SIDASE

(Geobacillus
stearothermophilus) 		PF02056
(Glyco_hydro_4)
PF11975
(Glyco_hydro_4C) 		5 HIS A 258
ALA A 198
ILE A 345
VAL A 377
ALA A 376
 None
 1.30A 1udtA-5c3mA:
undetectable		 1udtA-5c3mA:
21.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5cmn LATROPHILIN-3

(Homo sapiens) 		PF02191
(OLF) 		5 TYR E 143
ALA E 366
ILE E 364
LEU E 139
PHE E 357
 None
 1.26A 1udtA-5cmnE:
undetectable		 1udtA-5cmnE:
18.86
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.
5d7z LACTOYLGLUTATHIONE
LYASE

(Zea mays) 		PF00903
(Glyoxalase) 		5 ALA A 108
ILE A 111
ALA A 100
LEU A 155
PHE A  46
 None
 1.27A 1udtA-5d7zA:
undetectable		 1udtA-5d7zA:
21.22
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.
5e68 S-RIBOSYLHOMOCYSTEIN
E LYASE

(Salmonella
enterica) 		PF02664
(LuxS) 		5 HIS A  11
ALA A  22
VAL A   9
ALA A 160
LEU A 166
 None
 1.17A 1udtA-5e68A:
undetectable		 1udtA-5e68A:
18.24
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.
5f7r LMO0178 PROTEIN

(Listeria
monocytogenes) 		no annotation 5 TYR E 188
ILE E 185
VAL E 386
ALA E 383
LEU E 102
 None
 1.11A 1udtA-5f7rE:
undetectable		 1udtA-5f7rE:
20.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5fxn THERMOLYSIN

(Bacillus
thermoproteolyticus) 		PF01447
(Peptidase_M4)
PF02868
(Peptidase_M4_C) 		5 ALA A 309
ILE A 244
ALA A 286
LEU A 275
PHE A 267
 None
 1.02A 1udtA-5fxnA:
undetectable		 1udtA-5fxnA:
19.89
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5h2r PHOSPHODIESTERASE

(Trypanosoma
brucei) 		no annotation 5 TYR A 668
HIS A 669
VAL A 841
GLN A 875
PHE A 878
 LLN  A1003 ( 4.8A)
None
LLN  A1003 (-4.6A)
LLN  A1003 (-3.0A)
LLN  A1003 (-3.8A)
 0.46A 1udtA-5h2rA:
37.8		 1udtA-5h2rA:
32.95
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.
5jh8 PROBABLE CHITINASE

(Chromobacterium
violaceum) 		PF00704
(Glyco_hydro_18) 		5 ALA A  50
ILE A  51
VAL A  26
ALA A  25
PHE A 103
 None
MLZ  A 101 ( 4.2A)
None
None
MLZ  A 101 ( 2.9A)
 1.01A 1udtA-5jh8A:
undetectable		 1udtA-5jh8A:
21.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5n81 TYROCIDINE SYNTHASE
1

(Brevibacillus
parabrevis) 		no annotation 5 ASN A 100
ALA A 183
ILE A  39
LEU A 226
PHE A 240
 None
 1.29A 1udtA-5n81A:
undetectable		 1udtA-5n81A:
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.
5nd4 TUBULIN ALPHA CHAIN

(Bos taurus) 		PF00091
(Tubulin)
PF03953
(Tubulin_C) 		5 TYR A 319
ALA A 331
ILE A 335
VAL A 375
ALA A 273
 None
 1.10A 1udtA-5nd4A:
undetectable		 1udtA-5nd4A:
22.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5nd4 TUBULIN ALPHA CHAIN

(Bos taurus) 		PF00091
(Tubulin)
PF03953
(Tubulin_C) 		5 TYR A 319
ALA A 331
ILE A 335
VAL A 375
PHE A 296
 None
 1.11A 1udtA-5nd4A:
undetectable		 1udtA-5nd4A:
22.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5uqr 2-METHYLCITRATE
SYNTHASE,
MITOCHONDRIAL

(Aspergillus
fumigatus) 		no annotation 5 ALA A 175
ILE A 171
VAL A 213
ALA A 214
PHE A 159
 None
 1.31A 1udtA-5uqrA:
undetectable		 1udtA-5uqrA:
12.86
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.
5vld HISTIDINOL
DEHYDROGENASE,
CHLOROPLASTIC

(Medicago
truncatula) 		PF00815
(Histidinol_dh) 		5 HIS A 135
ASN A 407
TYR A 402
VAL A 183
ALA A 182
 None
None
HIS  A 501 (-4.4A)
None
None
 1.21A 1udtA-5vldA:
undetectable		 1udtA-5vldA:
22.10
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.
5vyw PYRUVATE CARBOXYLASE

(Lactococcus
lactis) 		PF00289
(Biotin_carb_N)
PF00682
(HMGL-like)
PF02436
(PYC_OADA)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2) 		5 ALA A  70
ILE A  66
ALA A  97
LEU A 107
PHE A  91
 None
 1.19A 1udtA-5vywA:
undetectable		 1udtA-5vywA:
14.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5w7d ACYLOXYACYL
HYDROLASE

(Mus musculus) 		no annotation 5 ALA A 368
ILE A 370
VAL A 303
LEU A 536
GLN A 538
 None
 1.31A 1udtA-5w7dA:
undetectable		 1udtA-5w7dA:
16.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5wm4 SALICYLATE-AMP
LIGASE

(Streptomyces
gandocaensis) 		no annotation 5 ALA A 285
ILE A 289
VAL A 299
ALA A 298
LEU A 347
 None
None
None
None
GOL  A 609 (-4.4A)
 1.30A 1udtA-5wm4A:
undetectable		 1udtA-5wm4A:
14.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5x04 DODECANOYL-[ACYL-CAR
RIER-PROTEIN]
HYDROLASE,
CHLOROPLASTIC

(Umbellularia
californica) 		no annotation 5 TYR A 316
ILE A 309
VAL A 129
ALA A 128
LEU A 289
 None
 1.33A 1udtA-5x04A:
undetectable		 1udtA-5x04A:
22.81
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.
5yqw PEPTIDE ABC
TRANSPORTER,
PERIPLASMIC
PEPTIDE-BINDING
PROTEIN

(Vibrio harveyi) 		no annotation 5 ASN A 255
ALA A 384
ILE A 382
VAL A 405
PHE A 269
 None
 1.16A 1udtA-5yqwA:
undetectable		 1udtA-5yqwA:
13.46
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.
6cu5 PROTEIN ARGININE
N-METHYLTRANSFERASE

(Naegleria
fowleri) 		no annotation 5 ALA A  64
ILE A  35
VAL A  47
LEU A 143
PHE A 150
 None
 1.30A 1udtA-6cu5A:
undetectable		 1udtA-6cu5A:
12.98