SIMILAR PATTERNS OF AMINO ACIDS FOR 1EE2_B_CHDB1250_1

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
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1cdo ALCOHOL
DEHYDROGENASE

(Gadus morhua) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 CYH A  46
HIS A  68
MET A 124
LEU A 142
CYH A 175
 ZN  A 376 ( 2.2A)
ZN  A 376 (-3.5A)
None
None
ZN  A 376 ( 2.2A)
 0.56A 1ee2B-1cdoA:
58.2		 1ee2B-1cdoA:
55.70
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1d1t ALCOHOL
DEHYDROGENASE CLASS
IV SIGMA CHAIN

(Homo sapiens) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		6 CYH A  46
HIS A  67
LEU A 110
LEU A 141
CYH A 174
VAL A 294
 ZN  A 376 ( 2.3A)
ZN  A 376 ( 3.3A)
None
ACT  A 501 (-4.8A)
ZN  A 376 (-2.0A)
NAD  A1377 ( 4.1A)
 0.53A 1ee2B-1d1tA:
63.4		 1ee2B-1d1tA:
70.51
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.
1e7s GDP-FUCOSE
SYNTHETASE

(Escherichia
coli) 		PF01370
(Epimerase) 		5 CYH A 147
LEU A 290
SER A 221
LEU A 103
ILE A 243
 None
 1.39A 1ee2B-1e7sA:
undetectable		 1ee2B-1e7sA:
22.41
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1ee2 ALCOHOL
DEHYDROGENASE

(Equus caballus) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		11 CYH A  46
SER A  48
LEU A  57
HIS A  67
LEU A 110
SER A 116
MET A 117
LEU A 140
CYH A 173
VAL A 293
ILE A 317
 ZN  A1300 ( 2.3A)
CHD  A1150 ( 2.5A)
CHD  A1150 (-4.5A)
ZN  A1300 ( 3.2A)
None
CHD  A1150 (-2.8A)
CHD  A1150 (-4.2A)
None
ZN  A1300 (-2.2A)
NAD  A1100 ( 4.0A)
CHD  A1150 ( 4.3A)
 0.12A 1ee2B-1ee2A:
68.6		 1ee2B-1ee2A:
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.
1exb KV BETA2 PROTEIN

(Rattus
norvegicus) 		PF00248
(Aldo_ket_red) 		5 SER A 319
MET A 241
LEU A 321
VAL A 114
ILE A  81
 None
None
NDP  A1000 (-4.0A)
None
None
 1.25A 1ee2B-1exbA:
undetectable		 1ee2B-1exbA:
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.
1fs0 ATP SYNTHASE GAMMA
SUBUNIT

(Escherichia
coli) 		PF00231
(ATP-synt) 		5 LEU G 189
HIS G  65
LEU G  68
VAL G 224
ILE G  53
 None
 1.16A 1ee2B-1fs0G:
undetectable		 1ee2B-1fs0G:
22.49
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.
1gns SUBTILISIN BPN'

(Bacillus
amyloliquefaciens) 		PF00082
(Peptidase_S8) 		5 SER A 125
HIS A  64
LEU A  42
SER A 207
ILE A  35
 CSO  A 221 ( 2.6A)
CSO  A 221 ( 4.3A)
None
None
None
 1.30A 1ee2B-1gnsA:
undetectable		 1ee2B-1gnsA:
24.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1jdz 5'-METHYLTHIOADENOSI
NE PHOSPHORYLASE

(Sulfolobus
solfataricus) 		PF01048
(PNP_UDP_1) 		5 LEU A  29
LEU A 138
LEU A 231
VAL A  20
ILE A  85
 None
 1.17A 1ee2B-1jdzA:
2.3		 1ee2B-1jdzA:
21.16
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.
1n7r HYALURONIDASE

(Streptococcus
pneumoniae) 		PF02278
(Lyase_8)
PF02884
(Lyase_8_C)
PF08124
(Lyase_8_N) 		5 LEU A 517
HIS A 483
LEU A 450
VAL A 513
ILE A 504
 None
 1.12A 1ee2B-1n7rA:
undetectable		 1ee2B-1n7rA:
18.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1nfi I-KAPPA-B-ALPHA

(Homo sapiens) 		PF00023
(Ank)
PF12796
(Ank_2) 		5 SER E 252
LEU E 272
HIS E 222
LEU E 221
ILE E 265
 None
 1.30A 1ee2B-1nfiE:
undetectable		 1ee2B-1nfiE:
17.99
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.
1o9j ALDEHYDE
DEHYDROGENASE,
CYTOSOLIC 1

(Elephantulus
edwardii) 		PF00171
(Aldedh) 		5 LEU A 164
LEU A  91
LEU A 175
VAL A 189
ILE A 208
 None
 1.40A 1ee2B-1o9jA:
undetectable		 1ee2B-1o9jA:
24.36
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1p0c NADP-DEPENDENT
ALCOHOL
DEHYDROGENASE

(Pelophylax
perezi) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 CYH A1046
SER A1048
HIS A1067
LEU A1140
CYH A1173
 ZN  A1502 ( 2.5A)
ZN  A1502 (-3.4A)
ZN  A1502 (-3.5A)
None
ZN  A1502 (-2.3A)
 1.11A 1ee2B-1p0cA:
60.4		 1ee2B-1p0cA:
58.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1pgp 6-PHOSPHOGLUCONATE
DEHYDROGENASE

(Ovis aries) 		PF00393
(6PGD)
PF03446
(NAD_binding_2) 		5 CYH A 365
SER A 139
HIS A 186
LEU A 352
ILE A 357
 None
None
6PG  A 502 ( 4.9A)
None
None
 1.18A 1ee2B-1pgpA:
3.4		 1ee2B-1pgpA:
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.
1qq0 CARBONIC ANHYDRASE

(Methanosarcina
thermophila) 		PF00132
(Hexapep)
PF14602
(Hexapep_2) 		5 LEU A 150
LEU A  80
SER A 119
VAL A 144
ILE A 109
 None
 1.38A 1ee2B-1qq0A:
undetectable		 1ee2B-1qq0A:
20.41
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1u3t ALCOHOL
DEHYDROGENASE ALPHA
CHAIN

(Homo sapiens) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		6 CYH A  46
HIS A  67
LEU A 141
CYH A 174
VAL A 294
ILE A 318
 ZN  A 376 (-2.2A)
ZN  A 376 ( 3.3A)
CCB  A1378 ( 4.8A)
ZN  A 376 (-2.2A)
NAD  A1377 ( 3.9A)
CCB  A1378 ( 4.0A)
 0.29A 1ee2B-1u3tA:
65.2		 1ee2B-1u3tA:
87.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1usy ATP
PHOSPHORIBOSYLTRANSF
ERASE REGULATORY
SUBUNIT

(Thermotoga
maritima) 		PF13393
(tRNA-synt_His) 		5 LEU C 110
LEU C 192
LEU C 237
VAL C 127
ILE C 223
 None
 1.10A 1ee2B-1usyC:
undetectable		 1ee2B-1usyC:
23.04
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.
1yb1 17-BETA-HYDROXYSTERO
ID DEHYDROGENASE
TYPE XI

(Homo sapiens) 		PF00106
(adh_short) 		5 SER A  56
LEU A  58
LEU A 241
VAL A  34
ILE A 245
 None
 1.15A 1ee2B-1yb1A:
8.9		 1ee2B-1yb1A:
21.56
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.
1yqd SINAPYL ALCOHOL
DEHYDROGENASE

(Populus
tremuloides) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 CYH A  50
SER A  52
HIS A  72
LEU A 122
CYH A 166
 ZN  A1000 (-2.3A)
DTT  A 700 (-2.4A)
ZN  A1000 ( 3.3A)
None
ZN  A1000 ( 2.3A)
 0.78A 1ee2B-1yqdA:
34.9		 1ee2B-1yqdA:
25.06
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.
2ae8 IMIDAZOLEGLYCEROL-PH
OSPHATE DEHYDRATASE

(Staphylococcus
aureus) 		PF00475
(IGPD) 		5 LEU A  76
LEU A  14
LEU A  49
VAL A 139
ILE A  68
 None
 1.20A 1ee2B-2ae8A:
undetectable		 1ee2B-2ae8A:
18.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2cb9 FENGYCIN SYNTHETASE

(Bacillus
subtilis) 		PF00975
(Thioesterase) 		5 CYH A  26
LEU A 205
LEU A  44
VAL A 110
ILE A 220
 None
 1.28A 1ee2B-2cb9A:
undetectable		 1ee2B-2cb9A:
22.42
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.
2ek8 AMINOPEPTIDASE

(Aneurinibacillus
sp. AM-1) 		PF02225
(PA)
PF04389
(Peptidase_M28) 		5 LEU A 300
HIS A 363
LEU A 334
LEU A 311
VAL A 247
 None
 1.22A 1ee2B-2ek8A:
3.5		 1ee2B-2ek8A:
22.62
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2fzw ALCOHOL
DEHYDROGENASE CLASS
III CHI CHAIN

(Homo sapiens) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 CYH A  44
HIS A  66
LEU A 109
CYH A 173
VAL A 293
 ZN  A 376 (-2.4A)
ZN  A 376 (-3.3A)
None
ZN  A 376 ( 3.0A)
NAD  A1377 (-4.6A)
 0.94A 1ee2B-2fzwA:
58.4		 1ee2B-2fzwA:
62.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2hoe N-ACETYLGLUCOSAMINE
KINASE

(Thermotoga
maritima) 		PF00480
(ROK) 		5 LEU A 168
LEU A 106
LEU A 116
VAL A 142
ILE A  87
 None
 1.08A 1ee2B-2hoeA:
undetectable		 1ee2B-2hoeA:
22.66
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.
2jh9 VP4 CORE PROTEIN

(Bluetongue
virus) 		PF05059
(Orbi_VP4) 		5 CYH A 318
HIS A 307
LEU A 386
MET A 369
LEU A 336
 None
 1.25A 1ee2B-2jh9A:
undetectable		 1ee2B-2jh9A:
21.26
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.
2kbo DNA DC->DU-EDITING
ENZYME APOBEC-3G

(Homo sapiens) 		PF08210
(APOBEC_N) 		5 HIS A  67
LEU A 181
SER A  94
CYH A  98
ILE A 124
 ZN  A 250 ( 3.1A)
None
None
ZN  A 250 ( 2.3A)
None
 1.39A 1ee2B-2kboA:
undetectable		 1ee2B-2kboA:
16.45
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.
2np5 TRANSCRIPTIONAL
REGULATOR

(Rhodococcus
jostii) 		PF00440
(TetR_N)
PF13977
(TetR_C_6) 		5 LEU A  61
LEU A 154
MET A 106
LEU A  68
ILE A 130
 None
None
None
None
LMT  A 204 ( 4.8A)
 1.38A 1ee2B-2np5A:
undetectable		 1ee2B-2np5A:
20.21
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.
2nq3 ITCHY HOMOLOG E3
UBIQUITIN PROTEIN
LIGASE

(Homo sapiens) 		PF00168
(C2) 		5 SER A  77
LEU A  79
LEU A 142
VAL A  47
ILE A  72
 None
 1.18A 1ee2B-2nq3A:
undetectable		 1ee2B-2nq3A:
16.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2p0u STILBENECARBOXYLATE
SYNTHASE 2

(Marchantia
polymorpha) 		PF00195
(Chal_sti_synt_N)
PF02797
(Chal_sti_synt_C) 		5 LEU A 189
MET A 257
LEU A 402
VAL A 240
ILE A 254
 None
 1.22A 1ee2B-2p0uA:
undetectable		 1ee2B-2p0uA:
22.05
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.
2p4q 6-PHOSPHOGLUCONATE
DEHYDROGENASE,
DECARBOXYLATING 1

(Saccharomyces
cerevisiae) 		PF00393
(6PGD)
PF03446
(NAD_binding_2) 		5 CYH A 365
SER A 139
HIS A 185
LEU A 352
ILE A 357
 None
None
FLC  A 502 (-4.5A)
None
None
 1.19A 1ee2B-2p4qA:
2.7		 1ee2B-2p4qA:
21.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qq6 MANDELATE
RACEMASE/MUCONATE
LACTONIZING
ENZYME-LIKE PROTEIN

(Rubrobacter
xylanophilus) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 LEU A  56
MET A  71
LEU A  89
CYH A  36
VAL A   9
 None
 1.41A 1ee2B-2qq6A:
2.6		 1ee2B-2qq6A:
23.19
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.
2vos FOLYLPOLYGLUTAMATE
SYNTHASE PROTEIN
FOLC

(Mycobacterium
tuberculosis) 		PF02875
(Mur_ligase_C)
PF08245
(Mur_ligase_M) 		5 SER A 251
LEU A 248
LEU A 306
MET A 244
VAL A 258
 None
 1.39A 1ee2B-2vosA:
2.6		 1ee2B-2vosA:
22.46
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.
2wbe BIPOLAR KINESIN
KRP-130

(Drosophila
melanogaster) 		PF00225
(Kinesin) 		5 MET C 101
LEU C 247
CYH C  85
VAL C  71
ILE C  76
 None
 1.35A 1ee2B-2wbeC:
undetectable		 1ee2B-2wbeC:
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.
2yg6 PUTRESCINE OXIDASE

(Rhodococcus
erythropolis) 		PF01593
(Amino_oxidase) 		5 SER A 398
LEU A 199
SER A 192
LEU A 188
ILE A 169
 None
 1.37A 1ee2B-2yg6A:
undetectable		 1ee2B-2yg6A:
22.15
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.
2yq1 ORF73

(Murid
gammaherpesvirus
4) 		no annotation 5 SER A 219
LEU A 230
LEU A 139
LEU A 185
VAL A 194
 None
 1.36A 1ee2B-2yq1A:
undetectable		 1ee2B-2yq1A:
17.05
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.
3bgk PUTATIVE
UNCHARACTERIZED
PROTEIN

(Streptococcus
mutans) 		PF01256
(Carb_kinase) 		5 LEU A  85
LEU A 124
LEU A  28
VAL A 113
ILE A 118
 None
 1.43A 1ee2B-3bgkA:
6.2		 1ee2B-3bgkA:
23.97
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.
3bmb REGULATOR OF
NUCLEOSIDE
DIPHOSPHATE KINASE

(Escherichia
coli) 		PF01272
(GreA_GreB)
PF14760
(Rnk_N) 		5 SER A  58
LEU A  75
LEU A  38
VAL A  54
ILE A   8
 None
 1.42A 1ee2B-3bmbA:
undetectable		 1ee2B-3bmbA:
18.08
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.
3d1r FRUCTOSE-1,6-BISPHOS
PHATASE CLASS II
GLPX

(Escherichia
coli) 		PF03320
(FBPase_glpX) 		5 LEU A 139
LEU A 233
LEU A 135
VAL A 170
ILE A 208
 None
 1.31A 1ee2B-3d1rA:
2.4		 1ee2B-3d1rA:
22.44
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.
3ddh PUTATIVE HALOACID
DEHALOGENASE-LIKE
FAMILY HYDROLASE

(Bacteroides
thetaiotaomicron) 		PF13419
(HAD_2) 		5 LEU A 229
LEU A 189
LEU A 175
VAL A 220
ILE A 185
 None
 1.12A 1ee2B-3ddhA:
5.9		 1ee2B-3ddhA:
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.
3eeg 2-ISOPROPYLMALATE
SYNTHASE

(Cytophaga
hutchinsonii) 		PF00682
(HMGL-like) 		5 SER A 214
LEU A 218
LEU A 266
MET A 248
VAL A 225
 None
 1.36A 1ee2B-3eegA:
2.4		 1ee2B-3eegA:
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.
3elu METHYLTRANSFERASE

(Wesselsbron
virus) 		PF00972
(Flavi_NS5)
PF01728
(FtsJ) 		5 SER A  54
LEU A 259
LEU A  71
VAL A 257
ILE A  62
 None
 1.38A 1ee2B-3eluA:
4.7		 1ee2B-3eluA:
21.84
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.
3fqd PROTEIN DIN1

(Schizosaccharomyces
pombe) 		PF08652
(RAI1) 		5 SER B 192
LEU B 194
LEU B 338
LEU B 316
ILE B 323
 None
 1.21A 1ee2B-3fqdB:
undetectable		 1ee2B-3fqdB:
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.
3ftb HISTIDINOL-PHOSPHATE
AMINOTRANSFERASE

(Clostridium
acetobutylicum) 		PF00155
(Aminotran_1_2) 		5 LEU A 316
LEU A 304
CYH A 326
VAL A 300
ILE A 323
 None
 0.99A 1ee2B-3ftbA:
4.6		 1ee2B-3ftbA:
19.80
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.
3fvw PUTATIVE
NAD(P)H-DEPENDENT
FMN REDUCTASE

(Streptococcus
mutans) 		PF03358
(FMN_red) 		5 LEU A 108
LEU A 178
MET A 140
LEU A 135
VAL A  65
 None
 1.26A 1ee2B-3fvwA:
3.5		 1ee2B-3fvwA:
19.84
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.
3gir AMINOMETHYLTRANSFERA
SE

(Bartonella
henselae) 		PF01571
(GCV_T)
PF08669
(GCV_T_C) 		5 LEU A  17
LEU A 170
LEU A  57
VAL A 152
ILE A 202
 None
 0.88A 1ee2B-3girA:
undetectable		 1ee2B-3girA:
22.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3i4y CATECHOL
1,2-DIOXYGENASE

(Rhodococcus
opacus) 		PF00775
(Dioxygenase_C)
PF04444
(Dioxygenase_N) 		5 LEU A 259
LEU A 120
LEU A 223
VAL A 271
ILE A 188
 None
 1.04A 1ee2B-3i4yA:
undetectable		 1ee2B-3i4yA:
24.51
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.
3ibs CONSERVED
HYPOTHETICAL PROTEIN
BATB

(Bacteroides
thetaiotaomicron) 		PF00092
(VWA) 		5 LEU A  42
LEU A 139
SER A 200
VAL A  47
ILE A 110
 None
 1.16A 1ee2B-3ibsA:
2.0		 1ee2B-3ibsA:
22.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3if8 PROTEIN ZWILCH
HOMOLOG
PROTEIN ZWILCH
HOMOLOG

(Homo sapiens;
Homo sapiens) 		PF09817
(Zwilch)
PF09817
(Zwilch) 		5 CYH B 495
LEU B 488
LEU A 208
LEU B 512
ILE A 225
 None
 1.10A 1ee2B-3if8B:
undetectable		 1ee2B-3if8B:
20.20
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.
3ife PEPTIDASE T

(Bacillus
anthracis) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		5 LEU A  48
HIS A 165
LEU A 157
VAL A 170
ILE A 399
 None
 1.41A 1ee2B-3ifeA:
undetectable		 1ee2B-3ifeA:
22.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3jbh MYOSIN 2 HEAVY CHAIN
STRIATED MUSCLE
MYOSIN 2 ESSENTIAL
LIGHT CHAIN STRIATED
MUSCLE

(Aphonopelma;
Aphonopelma) 		PF00063
(Myosin_head)
PF01576
(Myosin_tail_1)
PF02736
(Myosin_N)
no annotation 		5 LEU C  90
LEU C 117
LEU C 106
CYH C 129
ILE A 793
 None
 1.27A 1ee2B-3jbhC:
undetectable		 1ee2B-3jbhC:
19.35
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.
3jbh MYOSIN 2 HEAVY CHAIN
STRIATED MUSCLE
MYOSIN 2 ESSENTIAL
LIGHT CHAIN STRIATED
MUSCLE

(Aphonopelma;
Aphonopelma) 		PF00063
(Myosin_head)
PF01576
(Myosin_tail_1)
PF02736
(Myosin_N)
no annotation 		5 LEU C  90
LEU C 117
LEU C 106
VAL C 143
ILE A 793
 None
 1.40A 1ee2B-3jbhC:
undetectable		 1ee2B-3jbhC:
19.35
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.
3k1n HTH-TYPE
TRANSCRIPTIONAL
REGULATOR BENM

(Acinetobacter
sp. ADP1) 		PF00126
(HTH_1)
PF03466
(LysR_substrate) 		5 SER A 284
HIS A 116
LEU A 123
LEU A 119
ILE A 109
 None
 1.40A 1ee2B-3k1nA:
undetectable		 1ee2B-3k1nA:
20.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3k4u BINDING COMPONENT OF
ABC TRANSPORTER

(Wolinella
succinogenes) 		PF00497
(SBP_bac_3) 		5 LEU A 208
LEU A   5
LEU A  32
VAL A  83
ILE A  65
 None
 1.19A 1ee2B-3k4uA:
undetectable		 1ee2B-3k4uA:
23.45
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.
3mg6 PROTEASOME COMPONENT
PRE3

(Saccharomyces
cerevisiae) 		no annotation 5 SER N 158
LEU N 159
CYH N  44
VAL N   6
ILE N 126
 None
 1.19A 1ee2B-3mg6N:
undetectable		 1ee2B-3mg6N:
21.04
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.
3n6n RNA-DEPENDENT RNA
POLYMERASE

(Enterovirus A) 		PF00680
(RdRP_1) 		5 SER A 173
LEU A  58
SER A  45
LEU A  50
VAL A 158
 None
 0.93A 1ee2B-3n6nA:
undetectable		 1ee2B-3n6nA:
21.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3nbh RECQ-MEDIATED GENOME
INSTABILITY PROTEIN
1

(Homo sapiens) 		PF16099
(RMI1_C) 		5 LEU A 608
LEU A 517
LEU A 553
VAL A 605
ILE A 530
 None
 1.05A 1ee2B-3nbhA:
undetectable		 1ee2B-3nbhA:
17.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3nv0 NUCLEAR RNA EXPORT
FACTOR 2
NTF2-RELATED EXPORT
PROTEIN

(Caenorhabditis
elegans;
Caenorhabditis
elegans) 		no annotation
PF02136
(NTF2) 		5 LEU A 331
SER A 377
MET A 364
LEU B  96
VAL B  87
 PEG  B1004 ( 4.1A)
None
None
None
PEG  B1004 (-3.3A)
 1.43A 1ee2B-3nv0A:
undetectable		 1ee2B-3nv0A:
21.10
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.
3opq PHOSPHORIBOSYLAMINOI
MIDAZOLE
CARBOXYLASE,CATALYTI
C SUBUNIT

(Francisella
tularensis) 		PF00731
(AIRC) 		5 CYH A  34
LEU A  58
CYH A  22
VAL A   3
ILE A  30
 None
 1.42A 1ee2B-3opqA:
5.2		 1ee2B-3opqA:
15.97
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.
3tex PROTECTIVE ANTIGEN

(Bacillus
anthracis) 		PF03495
(Binary_toxB)
PF07691
(PA14)
PF17475
(Binary_toxB_2)
PF17476
(Binary_toxB_3) 		5 LEU A 450
LEU A 271
LEU A 421
VAL A 332
ILE A 269
 None
 1.01A 1ee2B-3texA:
undetectable		 1ee2B-3texA:
18.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3unn MEDIATOR OF DNA
DAMAGE CHECKPOINT
PROTEIN 1

(Homo sapiens) 		PF00498
(FHA) 		5 LEU A  66
LEU A 115
CYH A  92
VAL A  64
ILE A  78
 None
 1.38A 1ee2B-3unnA:
undetectable		 1ee2B-3unnA:
16.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3vw7 PROTEINASE-ACTIVATED
RECEPTOR 1, LYSOZYME

(Homo sapiens;
Escherichia
virus T4) 		PF00001
(7tm_1)
PF00959
(Phage_lysozyme) 		5 CYH A 365
SER A 116
LEU A 117
VAL A 152
ILE A 159
 OLC  A2005 (-3.5A)
None
None
None
OLC  A2004 ( 4.3A)
 1.32A 1ee2B-3vw7A:
undetectable		 1ee2B-3vw7A:
22.18
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.
4a2b CELL DIVISION
PROTEIN FTSA,
PUTATIVE

(Thermotoga
maritima) 		PF02491
(SHS2_FTSA)
PF14450
(FtsA) 		5 SER A 193
HIS A 131
LEU A 177
LEU A 130
ILE A  81
 None
 1.39A 1ee2B-4a2bA:
undetectable		 1ee2B-4a2bA:
21.51
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.
4av6 K(+)-STIMULATED
PYROPHOSPHATE-ENERGI
ZED SODIUM PUMP

(Thermotoga
maritima) 		PF03030
(H_PPase) 		5 SER A 454
LEU A 244
LEU A 424
SER A 505
ILE A 376
 None
 1.28A 1ee2B-4av6A:
undetectable		 1ee2B-4av6A:
19.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4b16 CHITINASE LIKE
LECTIN

(Tamarindus
indica) 		PF00704
(Glyco_hydro_18) 		5 SER A 159
LEU A 169
LEU A 145
LEU A 178
ILE A 125
 None
 1.28A 1ee2B-4b16A:
undetectable		 1ee2B-4b16A:
22.91
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.
4b3v E1 ENVELOPE
GLYCOPROTEIN

(Rubella virus) 		PF05748
(Rubella_E1) 		5 LEU A 257
LEU A  62
LEU A 289
VAL A  87
ILE A  50
 None
 1.02A 1ee2B-4b3vA:
undetectable		 1ee2B-4b3vA:
21.56
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.
4fd0 LEUCINE RICH
HYPOTHETICAL PROTEIN

(Bacteroides
caccae) 		PF07523
(Big_3)
PF13306
(LRR_5) 		5 CYH A 322
LEU A 282
LEU A 255
VAL A 303
ILE A 277
 None
 1.38A 1ee2B-4fd0A:
undetectable		 1ee2B-4fd0A:
23.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4fdw LEUCINE RICH
HYPOTHETICAL PROTEIN

(Bacteroides
ovatus) 		PF07523
(Big_3)
PF13306
(LRR_5) 		5 CYH A 322
LEU A 282
LEU A 255
VAL A 303
ILE A 277
 None
 1.25A 1ee2B-4fdwA:
undetectable		 1ee2B-4fdwA:
23.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4h2d NADPH-DEPENDENT
DIFLAVIN
OXIDOREDUCTASE 1

(Homo sapiens) 		PF00258
(Flavodoxin_1) 		5 LEU A  48
MET A  90
LEU A 116
CYH A  58
ILE A  55
 None
 1.38A 1ee2B-4h2dA:
undetectable		 1ee2B-4h2dA:
15.98
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.
4hnh NAD-DEPENDENT
EPIMERASE/DEHYDRATAS
E

(Veillonella
parvula) 		PF13460
(NAD_binding_10) 		5 LEU A  32
MET A  28
LEU A  22
VAL A  73
ILE A   7
 None
 1.20A 1ee2B-4hnhA:
5.4		 1ee2B-4hnhA:
19.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4iql ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
II

(Porphyromonas
gingivalis) 		PF03060
(NMO) 		5 CYH A  57
LEU A  50
SER A  44
MET A  45
VAL A  67
 None
None
NDP  A 402 (-2.8A)
NDP  A 402 ( 4.7A)
None
 1.33A 1ee2B-4iqlA:
undetectable		 1ee2B-4iqlA:
22.98
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.
4kc3 INTERLEUKIN-33

(Homo sapiens) 		PF15095
(IL33) 		5 LEU A 267
LEU A 247
LEU A 186
VAL A 228
ILE A 240
 None
 1.21A 1ee2B-4kc3A:
undetectable		 1ee2B-4kc3A:
17.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4kho UNCHARACTERIZED
PROTEIN SPT16M

(Chaetomium
thermophilum) 		PF08512
(Rtt106)
PF08644
(SPT16) 		5 LEU A 734
HIS A 731
LEU A 679
VAL A 709
ILE A 675
 None
 1.41A 1ee2B-4khoA:
undetectable		 1ee2B-4khoA:
20.20
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.
4oj5 TAILSPIKE PROTEIN

(Escherichia
virus CBA120) 		no annotation 5 LEU A 209
LEU A 354
LEU A 238
VAL A 254
ILE A 326
 None
 1.23A 1ee2B-4oj5A:
undetectable		 1ee2B-4oj5A:
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.
4oj5 TAILSPIKE PROTEIN

(Escherichia
virus CBA120) 		no annotation 5 LEU A 209
LEU A 354
LEU A 272
VAL A 254
ILE A 326
 None
 1.12A 1ee2B-4oj5A:
undetectable		 1ee2B-4oj5A:
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.
4okd ISOAMYLASE

(Chlamydomonas
reinhardtii) 		PF00128
(Alpha-amylase)
PF02922
(CBM_48) 		5 LEU A 509
MET A 524
LEU A 519
VAL A 378
ILE A 433
 None
 1.39A 1ee2B-4okdA:
undetectable		 1ee2B-4okdA:
16.92
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.
4toq CLASS III CHITINASE

(Punica granatum) 		PF00704
(Glyco_hydro_18) 		5 LEU A 100
LEU A 166
LEU A 137
VAL A  33
ILE A 126
 None
 1.21A 1ee2B-4toqA:
undetectable		 1ee2B-4toqA:
22.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4uyb SEC14-LIKE PROTEIN 3

(Homo sapiens) 		PF00650
(CRAL_TRIO) 		5 CYH A 254
LEU A 190
LEU A 237
CYH A  89
ILE A 152
 EDO  A1403 ( 3.8A)
None
None
EDO  A1403 ( 4.2A)
None
 1.39A 1ee2B-4uybA:
undetectable		 1ee2B-4uybA:
20.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4wwr LARGE PROLINE-RICH
PROTEIN BAG6
UBIQUITIN-LIKE
PROTEIN 4A

(Homo sapiens;
Homo sapiens) 		no annotation
no annotation 		5 HIS B 106
LEU B 119
LEU A1079
VAL A1088
ILE B  99
 None
 1.29A 1ee2B-4wwrB:
undetectable		 1ee2B-4wwrB:
10.43
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.
4xgc ORIGIN RECOGNITION
COMPLEX SUBUNIT 4

(Drosophila
melanogaster) 		PF13191
(AAA_16)
PF14629
(ORC4_C) 		5 SER D 168
LEU D 164
LEU D  84
LEU D 129
VAL D 177
 None
 1.20A 1ee2B-4xgcD:
undetectable		 1ee2B-4xgcD:
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.
4xmm NUCLEOPORIN NUP120

(Saccharomyces
cerevisiae) 		no annotation 5 SER E 683
LEU E 680
LEU E 698
SER E 615
LEU E 705
 None
 1.39A 1ee2B-4xmmE:
undetectable		 1ee2B-4xmmE:
14.64
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.
5a31 ANAPHASE-PROMOTING
COMPLEX SUBUNIT 1
THE
ANAPHASE-PROMOTING
COMPLEX CHAIN R

(Homo sapiens;
Homo sapiens) 		PF12859
(ANAPC1)
PF00400
(WD40)
PF12894
(ANAPC4_WD40) 		5 SER A1205
LEU A1208
HIS A1231
LEU R 100
LEU A1227
 None
 1.16A 1ee2B-5a31A:
undetectable		 1ee2B-5a31A:
13.79
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.
5cek TRIBBLES HOMOLOG 1

(Homo sapiens) 		PF00069
(Pkinase) 		5 LEU A 206
LEU A 314
MET A 273
VAL A 193
ILE A 332
 None
 1.40A 1ee2B-5cekA:
undetectable		 1ee2B-5cekA:
22.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5h42 UNCHARACTERIZED
PROTEIN

(Lachnoclostridium
phytofermentans) 		PF17167
(Glyco_hydro_36) 		5 LEU A 954
HIS A 926
LEU A 990
SER A 973
VAL A 958
 None
 1.18A 1ee2B-5h42A:
undetectable		 1ee2B-5h42A:
15.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5hb0 NUCLEOPORIN NUP170

(Chaetomium
thermophilum) 		no annotation 5 CYH B1259
LEU B1283
LEU B1359
VAL B1292
ILE B1319
 None
 1.37A 1ee2B-5hb0B:
undetectable		 1ee2B-5hb0B:
19.14
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.
5hmm EXODEOXYRIBONUCLEASE

(Escherichia
virus T5) 		PF01367
(5_3_exonuc)
PF02739
(5_3_exonuc_N) 		5 SER A 249
LEU A 253
LEU A 234
VAL A 209
ILE A 243
 None
 0.86A 1ee2B-5hmmA:
3.5		 1ee2B-5hmmA:
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.
5hzw MALTOSE-BINDING
PERIPLASMIC
PROTEIN,ENDOGLIN

(Escherichia
coli;
Homo sapiens) 		PF13416
(SBP_bac_8) 		5 SER A 558
HIS A 465
LEU A 478
LEU A 497
ILE A 568
 None
 1.37A 1ee2B-5hzwA:
undetectable		 1ee2B-5hzwA:
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.
5j46 PEPTIDE DEFORMYLASE

(Burkholderia
multivorans) 		PF01327
(Pep_deformylase) 		5 CYH A 106
SER A 108
LEU A  21
HIS A 152
LEU A  45
 ZN  A 200 (-2.3A)
None
None
ZN  A 200 (-3.3A)
None
 1.41A 1ee2B-5j46A:
undetectable		 1ee2B-5j46A:
19.35
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.
5jld ARGINYL-TRNA
SYNTHETASE, PUTATIVE

(Plasmodium
falciparum) 		PF00750
(tRNA-synt_1d)
PF03485
(Arg_tRNA_synt_N)
PF05746
(DALR_1) 		5 CYH A 340
LEU A 535
SER A 157
VAL A 375
ILE A 526
 None
 1.31A 1ee2B-5jldA:
2.6		 1ee2B-5jldA:
22.00
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.
5k51 HYPOXANTHINE-GUANINE
PHOSPHORIBOSYLTRANSF
ERASE

(Trypanosoma
brucei) 		PF00156
(Pribosyltran) 		5 SER A 136
HIS A 108
LEU A  67
CYH A  38
ILE A  31
 None
 1.40A 1ee2B-5k51A:
undetectable		 1ee2B-5k51A:
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.
5ljy ENVELOPMENT
POLYPROTEIN

(Hantaan
orthohantavirus) 		PF01561
(Hanta_G2) 		5 LEU A 375
HIS A 399
LEU A 343
LEU A 326
VAL A 373
 None
 1.29A 1ee2B-5ljyA:
undetectable		 1ee2B-5ljyA:
21.68
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.
5mp2 TYPE II SECRETION
SYSTEM PROTEIN D

(Pseudomonas
aeruginosa) 		no annotation 5 SER A 154
HIS A 207
LEU A 166
VAL A 151
ILE A 163
 None
 1.33A 1ee2B-5mp2A:
undetectable		 1ee2B-5mp2A:
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.
5ny5 3,4-DIHYDROXYBENZOAT
E DECARBOXYLASE

(Enterobacter
cloacae) 		PF01977
(UbiD) 		5 LEU A 234
LEU A 330
LEU A 212
VAL A 167
ILE A 169
 None
 1.13A 1ee2B-5ny5A:
undetectable		 1ee2B-5ny5A:
22.86
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.
5o3m PROTOCATECHUATE
DECARBOXYLASE

(Klebsiella
pneumoniae) 		PF01977
(UbiD) 		5 LEU A 234
LEU A 330
LEU A 212
VAL A 167
ILE A 169
 None
9JE  A 601 ( 4.3A)
None
None
9JE  A 601 ( 4.5A)
 1.11A 1ee2B-5o3mA:
undetectable		 1ee2B-5o3mA:
22.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5o5j 30S RIBOSOMAL
PROTEIN S9

(Mycolicibacterium
smegmatis) 		PF00380
(Ribosomal_S9) 		5 LEU I  41
LEU I  55
LEU I  72
VAL I  39
ILE I  68
 None
 1.38A 1ee2B-5o5jI:
undetectable		 1ee2B-5o5jI:
17.12
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.
5odo ISOMERASE

(Rhodococcus
erythropolis) 		no annotation 5 SER A 225
LEU A  78
LEU A  19
LEU A  90
ILE A 234
 None
 1.40A 1ee2B-5odoA:
3.3		 1ee2B-5odoA:
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.
5odr HETERODISULFIDE
REDUCTASE, SUBUNIT A
METHYL-VIOLOGEN
REDUCING
HYDROGENASE, SUBUNIT
G

(Methanothermococcus
thermolithotrophicus;
Methanothermococcus
thermolithotrophicus) 		PF07992
(Pyr_redox_2)
PF13187
(Fer4_9)
PF01058
(Oxidored_q6) 		5 CYH E 177
MET E 252
CYH E 207
VAL A 589
ILE E 191
 SF4  E 304 (-2.4A)
None
SF4  E 304 (-2.2A)
SF4  A 707 ( 4.1A)
None
 1.35A 1ee2B-5odrE:
2.3		 1ee2B-5odrE:
24.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5uj8 ORIGIN RECOGNITION
COMPLEX SUBUNIT 3

(Homo sapiens) 		PF07034
(ORC3_N) 		5 LEU A 230
MET A 222
LEU A 248
VAL A 267
ILE A 273
 None
 1.32A 1ee2B-5uj8A:
undetectable		 1ee2B-5uj8A:
18.03
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.
5xyn SUPPRESSOR OF
HYDROXYUREA
SENSITIVITY PROTEIN
2

(Saccharomyces
cerevisiae) 		no annotation 5 CYH D 116
HIS D 178
LEU D 186
CYH D 176
ILE D 109
 ZN  D 301 (-2.3A)
ZN  D 301 (-3.2A)
None
ZN  D 301 (-2.3A)
None
 1.23A 1ee2B-5xynD:
undetectable		 1ee2B-5xynD:
19.79
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.
5zvt N-TERMINUS OF OUTER
CAPSID PROTEIN VP5
C-TERMINUS OF OUTER
CAPSID PROTEIN VP5

(Aquareovirus C;
Aquareovirus C) 		no annotation
no annotation 		5 LEU B 163
LEU B 187
MET B 167
LEU B 218
ILE A  13
 None
MYR  A 101 (-4.2A)
MYR  A 101 (-3.6A)
None
MYR  A 101 (-4.7A)
 1.41A 1ee2B-5zvtB:
undetectable		 1ee2B-5zvtB:
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.
6ek4 PAXB

(Photorhabdus
luminescens) 		no annotation 5 SER A  54
LEU A 298
LEU A 146
VAL A 140
ILE A 145
 None
 1.24A 1ee2B-6ek4A:
undetectable		 1ee2B-6ek4A:
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.
6fhv GLUCOAMYLASE

(Penicillium
oxalicum) 		no annotation 5 SER A  41
LEU A 434
LEU A  30
LEU A 358
ILE A  34
 None
 1.38A 1ee2B-6fhvA:
undetectable		 1ee2B-6fhvA:
undetectable