SIMILAR PATTERNS OF AMINO ACIDS FOR 5HRQ_E_IPHE101_0

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.
1b5d PROTEIN
(DEOXYCYTIDYLATE
HYDROXYMETHYLASE)

(Escherichia
virus T4) 		PF00303
(Thymidylat_synt) 		4 ILE A  37
HIS A  14
LEU A  15
ALA A  18
 None
 0.92A 5hrqE-1b5dA:
undetectable
5hrqF-1b5dA:
undetectable
5hrqJ-1b5dA:
undetectable		 5hrqE-1b5dA:
9.35
5hrqF-1b5dA:
7.76
5hrqJ-1b5dA:
7.76
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.
1bd7 CIRCULARLY PERMUTED
BB2-CRYSTALLIN

(Rattus
norvegicus) 		PF00030
(Crystall) 		4 ILE A   3
HIS A  16
LEU A  25
ALA A  32
 None
 1.00A 5hrqE-1bd7A:
undetectable
5hrqF-1bd7A:
undetectable
5hrqJ-1bd7A:
undetectable		 5hrqE-1bd7A:
7.36
5hrqF-1bd7A:
10.91
5hrqJ-1bd7A:
10.91
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.
1cvm PHYTASE

(Bacillus
amyloliquefaciens) 		PF02333
(Phytase) 		4 ILE A 247
HIS A 254
LEU A 255
ALA A 285
 None
 0.93A 5hrqE-1cvmA:
undetectable
5hrqF-1cvmA:
undetectable
5hrqJ-1cvmA:
undetectable		 5hrqE-1cvmA:
4.84
5hrqF-1cvmA:
6.07
5hrqJ-1cvmA:
6.07
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.
1dl2 CLASS I
ALPHA-1,2-MANNOSIDAS
E

(Saccharomyces
cerevisiae) 		PF01532
(Glyco_hydro_47) 		4 ILE A  84
HIS A 528
LEU A 141
ALA A 144
 None
 0.99A 5hrqE-1dl2A:
undetectable
5hrqF-1dl2A:
undetectable
5hrqJ-1dl2A:
undetectable		 5hrqE-1dl2A:
3.69
5hrqF-1dl2A:
6.51
5hrqJ-1dl2A:
6.51
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.
1e7n BETA-CRYSTALLIN B2

(Mus musculus) 		PF00030
(Crystall) 		4 ILE A   3
HIS A  16
LEU A  25
ALA A  32
 None
 0.99A 5hrqE-1e7nA:
undetectable
5hrqF-1e7nA:
undetectable
5hrqJ-1e7nA:
undetectable		 5hrqE-1e7nA:
11.83
5hrqF-1e7nA:
16.83
5hrqJ-1e7nA:
16.83
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.
1e9m FERREDOXIN VI

(Rhodobacter
capsulatus) 		PF00111
(Fer2) 		4 ILE A   3
HIS A 100
LEU A 101
ALA A  50
 None
 0.64A 5hrqE-1e9mA:
undetectable
5hrqF-1e9mA:
undetectable
5hrqJ-1e9mA:
undetectable		 5hrqE-1e9mA:
13.70
5hrqF-1e9mA:
16.48
5hrqJ-1e9mA:
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.
1fa7 GLYOXALASE I

(Escherichia
coli) 		PF00903
(Glyoxalase) 		4 ILE A  75
HIS A   5
LEU A   3
ALA A  53
 None
CD  A1200 (-3.4A)
None
None
 1.01A 5hrqE-1fa7A:
undetectable
5hrqF-1fa7A:
undetectable
5hrqJ-1fa7A:
undetectable		 5hrqE-1fa7A:
8.15
5hrqF-1fa7A:
9.38
5hrqJ-1fa7A:
9.38
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.
1hkx CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE II ALPHA
CHAIN

(Mus musculus) 		PF08332
(CaMKII_AD) 		4 ILE A 351
HIS A 420
LEU A 421
ALA A 427
 None
None
TBR  A2000 (-3.9A)
None
 0.98A 5hrqE-1hkxA:
undetectable
5hrqF-1hkxA:
undetectable
5hrqJ-1hkxA:
undetectable		 5hrqE-1hkxA:
16.00
5hrqF-1hkxA:
13.91
5hrqJ-1hkxA:
13.91
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.
1iap GUANINE NUCLEOTIDE
EXCHANGE FACTOR
P115RHOGEF

(Homo sapiens) 		PF09128
(RGS-like) 		4 CYH A  77
HIS A 101
LEU A 104
ALA A 108
 None
 0.98A 5hrqE-1iapA:
undetectable
5hrqF-1iapA:
undetectable
5hrqJ-1iapA:
undetectable		 5hrqE-1iapA:
6.64
5hrqF-1iapA:
9.76
5hrqJ-1iapA:
9.76
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.
1kkm HPRK PROTEIN

(Lactobacillus
casei) 		PF07475
(Hpr_kinase_C) 		4 ILE A 211
HIS A 201
LEU A 175
ALA A 221
 None
 0.89A 5hrqE-1kkmA:
undetectable
5hrqF-1kkmA:
undetectable
5hrqJ-1kkmA:
undetectable		 5hrqE-1kkmA:
6.25
5hrqF-1kkmA:
15.62
5hrqJ-1kkmA:
15.62
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.
1la2 MYO-INOSITOL-1-PHOSP
HATE SYNTHASE

(Saccharomyces
cerevisiae) 		PF01658
(Inos-1-P_synth)
PF07994
(NAD_binding_5) 		4 CYH A 202
ILE A 185
LEU A 205
HIS A 219
 None
 0.71A 5hrqE-1la2A:
undetectable
5hrqF-1la2A:
undetectable
5hrqJ-1la2A:
undetectable		 5hrqE-1la2A:
3.71
5hrqF-1la2A:
7.10
5hrqJ-1la2A:
7.10
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.
1nav HORMONE RECEPTOR
ALPHA 1, THRA1

(Homo sapiens) 		PF00104
(Hormone_recep) 		4 ILE A 170
HIS A 175
LEU A 318
ALA A 321
 None
 0.87A 5hrqE-1navA:
undetectable
5hrqF-1navA:
undetectable
5hrqJ-1navA:
undetectable		 5hrqE-1navA:
9.25
5hrqF-1navA:
9.69
5hrqJ-1navA:
9.69
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.
1q5n 3-CARBOXY-CIS,CIS-MU
CONATE
CYCLOISOMERASE

(Acinetobacter
calcoaceticus) 		PF00206
(Lyase_1)
PF10397
(ADSL_C) 		4 CYH A 393
ILE A 406
HIS A 364
LEU A 366
 None
 0.93A 5hrqE-1q5nA:
undetectable
5hrqF-1q5nA:
undetectable
5hrqJ-1q5nA:
undetectable		 5hrqE-1q5nA:
4.28
5hrqF-1q5nA:
7.32
5hrqJ-1q5nA:
7.32
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.
1rt8 FIMBRIN

(Schizosaccharomyces
pombe) 		PF00307
(CH) 		4 ILE A 591
LEU A 611
ALA A 587
HIS A 606
 None
 1.00A 5hrqE-1rt8A:
undetectable
5hrqF-1rt8A:
undetectable
5hrqJ-1rt8A:
undetectable		 5hrqE-1rt8A:
4.53
5hrqF-1rt8A:
5.85
5hrqJ-1rt8A:
5.85
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.
1x1b CRTF-RELATED PROTEIN

(Chlorobaculum
tepidum) 		PF00891
(Methyltransf_2) 		4 CYH A 257
ILE A 255
LEU A 245
ALA A 248
 None
 0.85A 5hrqE-1x1bA:
undetectable
5hrqF-1x1bA:
undetectable
5hrqJ-1x1bA:
undetectable		 5hrqE-1x1bA:
5.43
5hrqF-1x1bA:
5.85
5hrqJ-1x1bA:
5.85
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.
1xfa CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR

(Mus musculus) 		PF00005
(ABC_tran)
PF14396
(CFTR_R) 		4 ILE A 456
HIS A 609
LEU A 610
ALA A 613
 None
 0.64A 5hrqE-1xfaA:
undetectable
5hrqF-1xfaA:
undetectable
5hrqJ-1xfaA:
undetectable		 5hrqE-1xfaA:
7.73
5hrqF-1xfaA:
10.50
5hrqJ-1xfaA:
10.50
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.
1xm7 HYPOTHETICAL PROTEIN
AQ_1665

(Aquifex
aeolicus) 		PF12850
(Metallophos_2) 		4 ILE A 107
HIS A 143
LEU A  48
ALA A 167
 None
 1.01A 5hrqE-1xm7A:
undetectable
5hrqF-1xm7A:
undetectable
5hrqJ-1xm7A:
undetectable		 5hrqE-1xm7A:
7.14
5hrqF-1xm7A:
9.58
5hrqJ-1xm7A:
9.58
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.
1ykw RUBISCO-LIKE PROTEIN

(Chlorobaculum
tepidum) 		PF00016
(RuBisCO_large)
PF02788
(RuBisCO_large_N) 		4 ILE A 185
HIS A 217
LEU A 218
ALA A 221
 None
 0.91A 5hrqE-1ykwA:
undetectable
5hrqF-1ykwA:
undetectable
5hrqJ-1ykwA:
undetectable		 5hrqE-1ykwA:
3.54
5hrqF-1ykwA:
5.31
5hrqJ-1ykwA:
5.31
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.
2acv TRITERPENE
UDP-GLUCOSYL
TRANSFERASE UGT71G1

(Medicago
truncatula) 		PF00201
(UDPGT) 		5 CYH A  46
ILE A  15
HIS A  22
LEU A  23
ALA A  26
 None
 1.00A 5hrqE-2acvA:
undetectable
5hrqF-2acvA:
undetectable
5hrqJ-2acvA:
undetectable		 5hrqE-2acvA:
3.77
5hrqF-2acvA:
5.35
5hrqJ-2acvA:
5.35
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.
2acv TRITERPENE
UDP-GLUCOSYL
TRANSFERASE UGT71G1

(Medicago
truncatula) 		PF00201
(UDPGT) 		5 ILE A  47
CYH A  46
HIS A  22
LEU A  23
ALA A  26
 None
 1.19A 5hrqE-2acvA:
undetectable
5hrqF-2acvA:
undetectable
5hrqJ-2acvA:
undetectable		 5hrqE-2acvA:
3.77
5hrqF-2acvA:
5.35
5hrqJ-2acvA:
5.35
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.
2ash QUEUINE
TRNA-RIBOSYLTRANSFER
ASE

(Thermotoga
maritima) 		PF01702
(TGT) 		4 ILE A  86
HIS A  20
LEU A  19
HIS A  77
 None
 1.00A 5hrqE-2ashA:
undetectable
5hrqF-2ashA:
undetectable
5hrqJ-2ashA:
undetectable		 5hrqE-2ashA:
6.32
5hrqF-2ashA:
6.86
5hrqJ-2ashA:
6.86
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.
2b1p MITOGEN-ACTIVATED
PROTEIN KINASE 10

(Homo sapiens) 		PF00069
(Pkinase) 		4 CYH A 175
ILE A 177
LEU A 354
ALA A 353
 None
 1.00A 5hrqE-2b1pA:
undetectable
5hrqF-2b1pA:
undetectable
5hrqJ-2b1pA:
undetectable		 5hrqE-2b1pA:
4.92
5hrqF-2b1pA:
11.79
5hrqJ-2b1pA:
11.79
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.
2de0 ALPHA-(1,6)-FUCOSYLT
RANSFERASE

(Homo sapiens) 		PF14604
(SH3_9) 		4 ILE X 427
HIS X 455
LEU X 457
ALA X 460
 None
 0.98A 5hrqE-2de0X:
undetectable
5hrqF-2de0X:
undetectable
5hrqJ-2de0X:
undetectable		 5hrqE-2de0X:
4.65
5hrqF-2de0X:
5.64
5hrqJ-2de0X:
5.64
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.
2dwc 433AA LONG
HYPOTHETICAL
PHOSPHORIBOSYLGLYCIN
AMIDE FORMYL
TRANSFERASE

(Pyrococcus
horikoshii) 		PF02222
(ATP-grasp) 		4 ILE A  34
LEU A 322
ALA A  85
HIS A 317
 None
 1.02A 5hrqE-2dwcA:
undetectable
5hrqF-2dwcA:
undetectable
5hrqJ-2dwcA:
undetectable		 5hrqE-2dwcA:
3.85
5hrqF-2dwcA:
6.18
5hrqJ-2dwcA:
6.18
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.
2dy0 ADENINE
PHOSPHORIBOSYLTRANSF
ERASE

(Escherichia
coli) 		PF00156
(Pribosyltran) 		4 ILE A  26
LEU A 158
ALA A 130
HIS A 183
 None
 1.00A 5hrqE-2dy0A:
undetectable
5hrqF-2dy0A:
undetectable
5hrqJ-2dy0A:
undetectable		 5hrqE-2dy0A:
18.03
5hrqF-2dy0A:
8.95
5hrqJ-2dy0A:
8.95
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.
2gah HETEROTETRAMERIC
SARCOSINE OXIDASE
GAMMA-SUBUNIT

(Stenotrophomonas
maltophilia) 		PF04268
(SoxG) 		4 ILE C 161
HIS C 187
LEU C 189
HIS C 184
 None
 0.94A 5hrqE-2gahC:
undetectable
5hrqF-2gahC:
undetectable
5hrqJ-2gahC:
undetectable		 5hrqE-2gahC:
7.26
5hrqF-2gahC:
9.19
5hrqJ-2gahC:
9.19
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.
2gtj FYN-BINDING PROTEIN

(Homo sapiens) 		PF07653
(SH3_2) 		4 ILE A  55
HIS A  29
LEU A  30
ALA A  31
 None
 0.97A 5hrqE-2gtjA:
undetectable
5hrqF-2gtjA:
undetectable
5hrqJ-2gtjA:
undetectable		 5hrqE-2gtjA:
10.23
5hrqF-2gtjA:
16.46
5hrqJ-2gtjA:
16.46
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.
2jm1 TRANSCRIPTIONAL
REGULATOR ATRX

(Homo sapiens) 		no annotation 4 CYH A 174
ILE A 196
ALA A 224
HIS A 189
 ZN  A   1 (-2.3A)
None
None
None
 0.90A 5hrqE-2jm1A:
undetectable
5hrqF-2jm1A:
undetectable
5hrqJ-2jm1A:
undetectable		 5hrqE-2jm1A:
13.91
5hrqF-2jm1A:
9.22
5hrqJ-2jm1A:
9.22
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.
2pyx TRYPTOPHAN
HALOGENASE

(Shewanella
frigidimarina) 		PF04820
(Trp_halogenase) 		4 ILE A  74
LEU A  24
ALA A  27
HIS A 183
 None
PG4  A 529 (-3.8A)
None
None
 0.91A 5hrqE-2pyxA:
undetectable
5hrqF-2pyxA:
undetectable
5hrqJ-2pyxA:
undetectable		 5hrqE-2pyxA:
4.19
5hrqF-2pyxA:
5.37
5hrqJ-2pyxA:
5.37
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.
2q1k ASCE

(Aeromonas
hydrophila) 		PF08988
(T3SS_needle_E) 		4 ILE A  60
HIS A  21
LEU A  20
ALA A  17
 None
 0.95A 5hrqE-2q1kA:
undetectable
5hrqF-2q1kA:
undetectable
5hrqJ-2q1kA:
undetectable		 5hrqE-2q1kA:
16.33
5hrqF-2q1kA:
18.75
5hrqJ-2q1kA:
18.75
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.
2rhq PHENYLALANYL-TRNA
SYNTHETASE BETA
CHAIN

(Staphylococcus
haemolyticus) 		PF01588
(tRNA_bind)
PF03147
(FDX-ACB)
PF03483
(B3_4)
PF03484
(B5) 		4 ILE B 519
HIS B 560
LEU B 561
ALA B 564
 None
 0.75A 5hrqE-2rhqB:
undetectable
5hrqF-2rhqB:
undetectable
5hrqJ-2rhqB:
undetectable		 5hrqE-2rhqB:
4.11
5hrqF-2rhqB:
5.97
5hrqJ-2rhqB:
5.97
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.
2vdc GLUTAMATE SYNTHASE
[NADPH] SMALL CHAIN

(Azospirillum
brasilense) 		PF07992
(Pyr_redox_2)
PF14691
(Fer4_20) 		4 CYH G  98
ILE G  93
LEU G 449
ALA G 453
 SF4  G 482 (-2.5A)
None
FAD  G 484 (-3.9A)
FAD  G 484 (-3.6A)
 0.94A 5hrqE-2vdcG:
undetectable
5hrqF-2vdcG:
undetectable
5hrqJ-2vdcG:
undetectable		 5hrqE-2vdcG:
5.84
5hrqF-2vdcG:
5.63
5hrqJ-2vdcG:
5.63
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.
2w2c CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE II DELTA
CHAIN

(Homo sapiens) 		PF08332
(CaMKII_AD) 		4 ILE A 351
HIS A 420
LEU A 421
ALA A 427
 None
 0.97A 5hrqE-2w2cA:
undetectable
5hrqF-2w2cA:
undetectable
5hrqJ-2w2cA:
undetectable		 5hrqE-2w2cA:
9.77
5hrqF-2w2cA:
14.78
5hrqJ-2w2cA:
14.78
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.
2w55 XANTHINE
DEHYDROGENASE

(Rhodobacter
capsulatus) 		PF01315
(Ald_Xan_dh_C)
PF02738
(Ald_Xan_dh_C2) 		4 ILE B  62
HIS B  34
LEU B  35
ALA B 109
 None
 0.89A 5hrqE-2w55B:
undetectable
5hrqF-2w55B:
undetectable
5hrqJ-2w55B:
undetectable		 5hrqE-2w55B:
2.58
5hrqF-2w55B:
4.45
5hrqJ-2w55B:
4.45
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.
2x7j 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE
-1-CARBOXYLATE
SYNTHASE

(Bacillus
subtilis) 		PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N)
PF16582
(TPP_enzyme_M_2) 		4 CYH A  28
ILE A  75
HIS A  49
ALA A  61
 None
 0.89A 5hrqE-2x7jA:
undetectable
5hrqF-2x7jA:
undetectable
5hrqJ-2x7jA:
undetectable		 5hrqE-2x7jA:
3.93
5hrqF-2x7jA:
4.60
5hrqJ-2x7jA:
4.60
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.
2xb6 NEUREXIN-1-BETA

(Rattus
norvegicus) 		PF02210
(Laminin_G_2) 		4 ILE C 168
HIS C 142
LEU C 126
ALA C 124
 None
 0.89A 5hrqE-2xb6C:
undetectable
5hrqF-2xb6C:
undetectable
5hrqJ-2xb6C:
undetectable		 5hrqE-2xb6C:
7.69
5hrqF-2xb6C:
12.00
5hrqJ-2xb6C:
12.00
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.
2xyd ANGIOTENSIN-CONVERTI
NG ENZYME

(Homo sapiens) 		PF01401
(Peptidase_M2) 		4 ILE A 264
HIS A 226
LEU A 225
ALA A 434
 None
 0.89A 5hrqE-2xydA:
undetectable
5hrqF-2xydA:
undetectable
5hrqJ-2xydA:
undetectable		 5hrqE-2xydA:
3.46
5hrqF-2xydA:
7.17
5hrqJ-2xydA:
7.17
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.
2z0q RHO GUANINE
NUCLEOTIDE EXCHANGE
FACTOR 3

(Mus musculus) 		PF00621
(RhoGEF) 		4 ILE A  90
HIS A 176
LEU A 177
ALA A 180
 None
 0.99A 5hrqE-2z0qA:
undetectable
5hrqF-2z0qA:
undetectable
5hrqJ-2z0qA:
undetectable		 5hrqE-2z0qA:
4.85
5hrqF-2z0qA:
6.65
5hrqJ-2z0qA:
6.65
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.
2zf5 GLYCEROL KINASE

(Thermococcus
kodakarensis) 		PF00370
(FGGY_N)
PF02782
(FGGY_C) 		4 ILE O 358
HIS O 368
LEU O 369
ALA O 372
 None
 1.02A 5hrqE-2zf5O:
undetectable
5hrqF-2zf5O:
undetectable
5hrqJ-2zf5O:
undetectable		 5hrqE-2zf5O:
3.62
5hrqF-2zf5O:
4.51
5hrqJ-2zf5O:
4.51
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.
3ad9 SARCOSINE OXIDASE
GAMMA SUBUNIT

(Corynebacterium
sp. U-96) 		PF04268
(SoxG) 		4 ILE C 159
HIS C 185
LEU C 187
HIS C 182
 None
 0.97A 5hrqE-3ad9C:
undetectable
5hrqF-3ad9C:
undetectable
5hrqJ-3ad9C:
undetectable		 5hrqE-3ad9C:
8.63
5hrqF-3ad9C:
12.16
5hrqJ-3ad9C:
12.16
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.
3asi NEUREXIN-1-ALPHA

(Bos taurus) 		PF02210
(Laminin_G_2) 		4 ILE A1170
HIS A1144
LEU A1128
ALA A1126
 None
 0.87A 5hrqE-3asiA:
undetectable
5hrqF-3asiA:
undetectable
5hrqJ-3asiA:
undetectable		 5hrqE-3asiA:
4.32
5hrqF-3asiA:
8.37
5hrqJ-3asiA:
8.37
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.
3fw6 CELLULASE

(uncultured
bacterium) 		PF12891
(Glyco_hydro_44) 		4 ILE A 217
HIS A  71
LEU A  70
ALA A 424
 None
 0.88A 5hrqE-3fw6A:
undetectable
5hrqF-3fw6A:
undetectable
5hrqJ-3fw6A:
undetectable		 5hrqE-3fw6A:
3.74
5hrqF-3fw6A:
5.23
5hrqJ-3fw6A:
5.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3h90 FERROUS-IRON EFFLUX
PUMP FIEF

(Escherichia
coli) 		PF01545
(Cation_efflux)
PF16916
(ZT_dimer) 		4 ILE A 245
HIS A 248
LEU A 249
ALA A 231
 None
ZN  A 293 (-3.2A)
None
None
 0.98A 5hrqE-3h90A:
undetectable
5hrqF-3h90A:
undetectable
5hrqJ-3h90A:
undetectable		 5hrqE-3h90A:
5.12
5hrqF-3h90A:
6.05
5hrqJ-3h90A:
6.05
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.
3htx HEN1

(Arabidopsis
thaliana) 		PF13847
(Methyltransf_31) 		4 CYH A 807
ILE A 798
LEU A 876
ALA A 873
 None
 1.01A 5hrqE-3htxA:
undetectable
5hrqF-3htxA:
undetectable
5hrqJ-3htxA:
undetectable		 5hrqE-3htxA:
2.19
5hrqF-3htxA:
3.25
5hrqJ-3htxA:
3.25
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.
3ic5 PUTATIVE
SACCHAROPINE
DEHYDROGENASE

(Ruegeria
pomeroyi) 		PF03435
(Sacchrp_dh_NADP) 		4 CYH A   6
ILE A  71
HIS A  92
ALA A  86
 None
 0.98A 5hrqE-3ic5A:
undetectable
5hrqF-3ic5A:
undetectable
5hrqJ-3ic5A:
undetectable		 5hrqE-3ic5A:
7.48
5hrqF-3ic5A:
14.41
5hrqJ-3ic5A:
14.41
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.
3j47 26S PROTEASOME
REGULATORY SUBUNIT
RPN3
26S PROTEASOME
REGULATORY SUBUNIT
RPN8

(Saccharomyces
cerevisiae;
Saccharomyces
cerevisiae) 		PF08375
(Rpn3_C)
PF13012
(MitMem_reg) 		4 ILE U 286
HIS S 472
LEU S 471
ALA S 468
 None
 0.81A 5hrqE-3j47U:
undetectable
5hrqF-3j47U:
undetectable
5hrqJ-3j47U:
undetectable		 5hrqE-3j47U:
12.00
5hrqF-3j47U:
20.73
5hrqJ-3j47U:
20.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3jro NUCLEOPORIN NUP84

(Saccharomyces
cerevisiae) 		PF04121
(Nup84_Nup100) 		4 CYH C 213
ILE C 211
LEU C 197
ALA C 200
 None
 0.81A 5hrqE-3jroC:
undetectable
5hrqF-3jroC:
undetectable
5hrqJ-3jroC:
undetectable		 5hrqE-3jroC:
3.73
5hrqF-3jroC:
16.15
5hrqJ-3jroC:
16.15
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.
3jrt INTEGRON CASSETTE
PROTEIN VPC_CASS2

(Vibrio
paracholerae) 		no annotation 4 CYH A  61
ILE A  59
LEU A  21
ALA A  24
 None
 0.54A 5hrqE-3jrtA:
undetectable
5hrqF-3jrtA:
undetectable
5hrqJ-3jrtA:
undetectable		 5hrqE-3jrtA:
9.80
5hrqF-3jrtA:
10.92
5hrqJ-3jrtA:
10.92
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.
3k7y ASPARTATE
AMINOTRANSFERASE

(Plasmodium
falciparum) 		PF00155
(Aminotran_1_2) 		4 ILE A  98
CYH A  99
LEU A 261
ALA A 260
 None
 0.95A 5hrqE-3k7yA:
undetectable
5hrqF-3k7yA:
undetectable
5hrqJ-3k7yA:
undetectable		 5hrqE-3k7yA:
4.26
5hrqF-3k7yA:
7.47
5hrqJ-3k7yA:
7.47
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.
3kog PUTATIVE
PORE-FORMING TOXIN

(Bacteroides
vulgatus) 		PF12985
(DUF3869) 		4 ILE A 253
HIS A 258
ALA A 203
HIS A 256
 None
 1.02A 5hrqE-3kogA:
undetectable
5hrqF-3kogA:
undetectable
5hrqJ-3kogA:
undetectable		 5hrqE-3kogA:
5.86
5hrqF-3kogA:
8.02
5hrqJ-3kogA:
8.02
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.
3mel THIAMIN
PYROPHOSPHOKINASE
FAMILY PROTEIN

(Enterococcus
faecalis) 		PF04263
(TPK_catalytic)
PF04265
(TPK_B1_binding) 		4 ILE A  99
HIS A  35
LEU A  36
ALA A  39
 None
 0.94A 5hrqE-3melA:
undetectable
5hrqF-3melA:
undetectable
5hrqJ-3melA:
undetectable		 5hrqE-3melA:
9.20
5hrqF-3melA:
12.50
5hrqJ-3melA:
12.50
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.
3mw2 NEUREXIN-1-ALPHA

(Mus musculus) 		PF02210
(Laminin_G_2) 		4 ILE A 168
HIS A 142
LEU A 126
ALA A 124
 None
 0.90A 5hrqE-3mw2A:
undetectable
5hrqF-3mw2A:
undetectable
5hrqJ-3mw2A:
undetectable		 5hrqE-3mw2A:
6.60
5hrqF-3mw2A:
10.00
5hrqJ-3mw2A:
10.00
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.
3n79 PDUT

(Salmonella
enterica) 		PF00936
(BMC) 		5 ILE A 109
CYH A 108
HIS A  78
LEU A 123
ALA A 115
 None
 1.31A 5hrqE-3n79A:
undetectable
5hrqF-3n79A:
undetectable
5hrqJ-3n79A:
undetectable		 5hrqE-3n79A:
6.42
5hrqF-3n79A:
7.81
5hrqJ-3n79A:
7.81
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.
3no5 UNCHARACTERIZED
PROTEIN

(Cupriavidus
pinatubonensis) 		PF05853
(BKACE) 		4 ILE A 150
HIS A 167
LEU A 166
ALA A 199
 None
 0.96A 5hrqE-3no5A:
undetectable
5hrqF-3no5A:
undetectable
5hrqJ-3no5A:
undetectable		 5hrqE-3no5A:
7.33
5hrqF-3no5A:
9.45
5hrqJ-3no5A:
9.45
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.
3poy NEUREXIN-1-ALPHA

(Bos taurus) 		PF00008
(EGF)
PF02210
(Laminin_G_2) 		4 ILE A1230
HIS A1204
LEU A1188
ALA A1186
 None
 0.94A 5hrqE-3poyA:
undetectable
5hrqF-3poyA:
undetectable
5hrqJ-3poyA:
undetectable		 5hrqE-3poyA:
1.90
5hrqF-3poyA:
2.88
5hrqJ-3poyA:
2.88
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.
3q4d MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY
POSSIBLE
CHLOROMUCONATE
CYCLOISOMERASE

(Cytophaga
hutchinsonii) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 ILE A 342
HIS A 306
LEU A 309
ALA A 308
 None
 1.00A 5hrqE-3q4dA:
undetectable
5hrqF-3q4dA:
undetectable
5hrqJ-3q4dA:
undetectable		 5hrqE-3q4dA:
4.93
5hrqF-3q4dA:
6.49
5hrqJ-3q4dA:
6.49
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.
3qcw NEUREXIN-1-ALPHA

(Bos taurus) 		PF00008
(EGF)
PF02210
(Laminin_G_2) 		4 ILE A1214
HIS A1188
LEU A1172
ALA A1170
 None
 0.89A 5hrqE-3qcwA:
undetectable
5hrqF-3qcwA:
undetectable
5hrqJ-3qcwA:
undetectable		 5hrqE-3qcwA:
1.70
5hrqF-3qcwA:
2.49
5hrqJ-3qcwA:
2.49
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.
3r03 NUDIX HYDROLASE

(Rhodospirillum
rubrum) 		PF14815
(NUDIX_4) 		4 ILE A  22
HIS A  94
ALA A  92
HIS A 100
 None
 0.95A 5hrqE-3r03A:
undetectable
5hrqF-3r03A:
undetectable
5hrqJ-3r03A:
undetectable		 5hrqE-3r03A:
9.02
5hrqF-3r03A:
10.42
5hrqJ-3r03A:
10.42
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.
3siv NHP2-LIKE PROTEIN 1

(Homo sapiens) 		PF01248
(Ribosomal_L7Ae) 		4 CYH A  73
LEU A  46
ALA A  42
HIS A  68
 None
 0.96A 5hrqE-3sivA:
undetectable
5hrqF-3sivA:
undetectable
5hrqJ-3sivA:
undetectable		 5hrqE-3sivA:
10.00
5hrqF-3sivA:
12.73
5hrqJ-3sivA:
12.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4chm IMC SUB-COMPARTMENT
PROTEIN ISP1

(Toxoplasma
gondii) 		no annotation 4 ILE A 112
HIS A 146
LEU A 120
ALA A 144
 None
 0.94A 5hrqE-4chmA:
undetectable
5hrqF-4chmA:
undetectable
5hrqJ-4chmA:
undetectable		 5hrqE-4chmA:
12.17
5hrqF-4chmA:
11.50
5hrqJ-4chmA:
11.50
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.
4czx PAB-DEPENDENT
POLY(A)-SPECIFIC
RIBONUCLEASE SUBUNIT
PAN2

(Neurospora
crassa) 		no annotation 4 ILE A 192
LEU A 219
ALA A 243
HIS A 188
 None
 0.88A 5hrqE-4czxA:
undetectable
5hrqF-4czxA:
undetectable
5hrqJ-4czxA:
undetectable		 5hrqE-4czxA:
4.89
5hrqF-4czxA:
7.61
5hrqJ-4czxA:
7.61
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.
4d0k A-SPECIFIC
RIBONUCLEASE SUBUNIT
PAN2

(Chaetomium
thermophilum) 		no annotation 4 ILE A 190
LEU A 217
ALA A 241
HIS A 186
 None
 0.96A 5hrqE-4d0kA:
undetectable
5hrqF-4d0kA:
undetectable
5hrqJ-4d0kA:
undetectable		 5hrqE-4d0kA:
4.25
5hrqF-4d0kA:
4.80
5hrqJ-4d0kA:
4.80
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.
4g1t INTERFERON-INDUCED
PROTEIN WITH
TETRATRICOPEPTIDE
REPEATS 2

(Homo sapiens) 		PF13181
(TPR_8) 		4 CYH A 289
ILE A 287
LEU A 323
ALA A 326
 None
 0.90A 5hrqE-4g1tA:
undetectable
5hrqF-4g1tA:
undetectable
5hrqJ-4g1tA:
undetectable		 5hrqE-4g1tA:
4.53
5hrqF-4g1tA:
6.40
5hrqJ-4g1tA:
6.40
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.
4gyo RESPONSE REGULATOR
ASPARTATE
PHOSPHATASE J

(Bacillus
subtilis) 		PF13424
(TPR_12) 		4 ILE A 185
HIS A 202
LEU A 203
ALA A 206
 None
 0.94A 5hrqE-4gyoA:
undetectable
5hrqF-4gyoA:
undetectable
5hrqJ-4gyoA:
undetectable		 5hrqE-4gyoA:
5.97
5hrqF-4gyoA:
6.41
5hrqJ-4gyoA:
6.41
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.
4h2d NADPH-DEPENDENT
DIFLAVIN
OXIDOREDUCTASE 1

(Homo sapiens) 		PF00258
(Flavodoxin_1) 		4 ILE A  55
HIS A 113
LEU A 112
ALA A 109
 None
 0.87A 5hrqE-4h2dA:
undetectable
5hrqF-4h2dA:
undetectable
5hrqJ-4h2dA:
undetectable		 5hrqE-4h2dA:
7.98
5hrqF-4h2dA:
9.82
5hrqJ-4h2dA:
9.82
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.
4hkt INOSITOL
2-DEHYDROGENASE

(Sinorhizobium
meliloti) 		PF01408
(GFO_IDH_MocA)
PF02894
(GFO_IDH_MocA_C) 		4 ILE A  68
CYH A  69
LEU A   7
ALA A  33
 None
 1.01A 5hrqE-4hktA:
undetectable
5hrqF-4hktA:
undetectable
5hrqJ-4hktA:
undetectable		 5hrqE-4hktA:
8.97
5hrqF-4hktA:
6.41
5hrqJ-4hktA:
6.41
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.
4ig8 2'-5'-OLIGOADENYLATE
SYNTHASE 1

(Homo sapiens) 		PF01909
(NTP_transf_2)
PF10421
(OAS1_C) 		4 CYH A  38
ILE A  36
LEU A  78
ALA A  76
 U  C   4 ( 3.3A)
None
None
None
 0.95A 5hrqE-4ig8A:
undetectable
5hrqF-4ig8A:
undetectable
5hrqJ-4ig8A:
undetectable		 5hrqE-4ig8A:
7.85
5hrqF-4ig8A:
8.28
5hrqJ-4ig8A:
8.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4k05 CONSERVED
HYPOTHETICAL
EXPORTED PROTEIN

(Bacteroides
fragilis) 		PF07075
(DUF1343) 		4 ILE A  72
HIS A  79
LEU A  78
ALA A  81
 None
None
None
K  A 501 (-4.7A)
 0.94A 5hrqE-4k05A:
undetectable
5hrqF-4k05A:
undetectable
5hrqJ-4k05A:
undetectable		 5hrqE-4k05A:
7.84
5hrqF-4k05A:
9.86
5hrqJ-4k05A:
9.86
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.
4kds PLASMINOGEN
ACTIVATOR INHIBITOR
1

(Oncorhynchus
mykiss) 		PF00079
(Serpin) 		4 ILE A 356
HIS A 164
LEU A 163
ALA A 331
 None
 0.96A 5hrqE-4kdsA:
undetectable
5hrqF-4kdsA:
undetectable
5hrqJ-4kdsA:
undetectable		 5hrqE-4kdsA:
4.15
5hrqF-4kdsA:
7.63
5hrqJ-4kdsA:
7.63
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.
4lis UDP-GLUCOSE
4-EPIMERASE

(Aspergillus
nidulans) 		PF16363
(GDP_Man_Dehyd) 		4 ILE A 123
HIS A 263
LEU A 267
ALA A 266
 None
 0.93A 5hrqE-4lisA:
undetectable
5hrqF-4lisA:
undetectable
5hrqJ-4lisA:
undetectable		 5hrqE-4lisA:
3.26
5hrqF-4lisA:
5.07
5hrqJ-4lisA:
5.07
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.
4lun NONSENSE-MEDIATED
MRNA DECAY PROTEIN 2

(Saccharomyces
cerevisiae) 		PF02854
(MIF4G) 		4 ILE U 290
HIS U 254
LEU U 253
ALA U 250
 None
 1.00A 5hrqE-4lunU:
undetectable
5hrqF-4lunU:
undetectable
5hrqJ-4lunU:
undetectable		 5hrqE-4lunU:
7.83
5hrqF-4lunU:
7.69
5hrqJ-4lunU:
7.69
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.
4oxr MANGANESE ABC
TRANSPORTER,
PERIPLASMIC-BINDING
PROTEIN SITA

(Staphylococcus
pseudintermedius) 		PF01297
(ZnuA) 		4 ILE A  83
HIS A  54
LEU A  76
ALA A  79
 None
 0.96A 5hrqE-4oxrA:
undetectable
5hrqF-4oxrA:
undetectable
5hrqJ-4oxrA:
undetectable		 5hrqE-4oxrA:
9.94
5hrqF-4oxrA:
7.53
5hrqJ-4oxrA:
7.53
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.
4q8h PAB-DEPENDENT
POLY(A)-SPECIFIC
RIBONUCLEASE SUBUNIT
PAN2

(Saccharomyces
cerevisiae) 		PF00929
(RNase_T)
PF13423
(UCH_1) 		4 ILE A1026
HIS A1023
LEU A 939
ALA A 911
 None
 0.86A 5hrqE-4q8hA:
undetectable
5hrqF-4q8hA:
undetectable
5hrqJ-4q8hA:
undetectable		 5hrqE-4q8hA:
3.53
5hrqF-4q8hA:
4.28
5hrqJ-4q8hA:
4.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4uwq SOXY PROTEIN

(Thermus
thermophilus) 		PF13501
(SoxY) 		4 ILE B 102
HIS B  38
LEU B  39
ALA B  42
 None
 0.81A 5hrqE-4uwqB:
undetectable
5hrqF-4uwqB:
undetectable
5hrqJ-4uwqB:
undetectable		 5hrqE-4uwqB:
7.14
5hrqF-4uwqB:
16.00
5hrqJ-4uwqB:
16.00
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.
4xr7 PAB-DEPENDENT
POLY(A)-SPECIFIC
RIBONUCLEASE SUBUNIT
PAN2

(Saccharomyces
cerevisiae) 		no annotation 4 ILE G1026
HIS G1023
LEU G 939
ALA G 911
 None
 1.00A 5hrqE-4xr7G:
undetectable
5hrqF-4xr7G:
undetectable
5hrqJ-4xr7G:
undetectable		 5hrqE-4xr7G:
2.95
5hrqF-4xr7G:
4.28
5hrqJ-4xr7G:
4.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4yai C
ALPHA-DEHYDROGENASE

(Sphingobium sp.
SYK-6) 		PF00106
(adh_short) 		4 ILE A  10
HIS A  41
LEU A  42
ALA A  45
 None
NAI  A 500 (-3.9A)
None
None
 0.81A 5hrqE-4yaiA:
undetectable
5hrqF-4yaiA:
undetectable
5hrqJ-4yaiA:
undetectable		 5hrqE-4yaiA:
5.86
5hrqF-4yaiA:
6.81
5hrqJ-4yaiA:
6.81
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.
4yk3 BEPE PROTEIN

(Bartonella
henselae) 		no annotation 4 CYH A 167
HIS A 230
LEU A 231
ALA A 234
 None
 0.66A 5hrqE-4yk3A:
undetectable
5hrqF-4yk3A:
undetectable
5hrqJ-4yk3A:
undetectable		 5hrqE-4yk3A:
11.22
5hrqF-4yk3A:
13.01
5hrqJ-4yk3A:
13.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4yme SENSORY BOX/GGDEF
FAMILY PROTEIN

(Caulobacter
vibrioides) 		PF00990
(GGDEF) 		4 ILE A 409
CYH A 408
LEU A 450
ALA A 448
 None
 1.00A 5hrqE-4ymeA:
undetectable
5hrqF-4ymeA:
undetectable
5hrqJ-4ymeA:
undetectable		 5hrqE-4ymeA:
8.50
5hrqF-4ymeA:
30.00
5hrqJ-4ymeA:
30.00
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.
4zc0 REPLICATIVE DNA
HELICASE

(Helicobacter
pylori) 		PF00772
(DnaB)
PF03796
(DnaB_C) 		4 HIS A   6
LEU A  10
ALA A 104
HIS A   3
 None
 0.96A 5hrqE-4zc0A:
undetectable
5hrqF-4zc0A:
undetectable
5hrqJ-4zc0A:
undetectable		 5hrqE-4zc0A:
4.21
5hrqF-4zc0A:
5.04
5hrqJ-4zc0A:
5.04
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.
4zqb NADP-DEPENDENT
DEHYDROGENASE

(Rhodobacter
sphaeroides) 		PF02826
(2-Hacid_dh_C) 		4 ILE A 289
HIS A  21
LEU A  22
ALA A  25
 None
 0.92A 5hrqE-4zqbA:
undetectable
5hrqF-4zqbA:
undetectable
5hrqJ-4zqbA:
undetectable		 5hrqE-4zqbA:
6.31
5hrqF-4zqbA:
7.97
5hrqJ-4zqbA:
7.97
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.
4zsf BSAWI ENDONUCLEASE

(Geobacillus
stearothermophilus) 		no annotation 4 ILE A   8
CYH A   7
HIS A  60
ALA A  32
 None
 0.95A 5hrqE-4zsfA:
undetectable
5hrqF-4zsfA:
undetectable
5hrqJ-4zsfA:
undetectable		 5hrqE-4zsfA:
7.92
5hrqF-4zsfA:
9.52
5hrqJ-4zsfA:
9.52
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.
5cd8 MATERNAL EFFECT
PROTEIN OSKAR

(Drosophila
melanogaster) 		PF12872
(OST-HTH) 		4 ILE A 216
HIS A 167
LEU A 164
ALA A 168
 None
 0.95A 5hrqE-5cd8A:
undetectable
5hrqF-5cd8A:
undetectable
5hrqJ-5cd8A:
undetectable		 5hrqE-5cd8A:
12.64
5hrqF-5cd8A:
19.61
5hrqJ-5cd8A:
19.61
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.
5j6s ENDOPLASMIC
RETICULUM
AMINOPEPTIDASE 2

(Homo sapiens) 		PF01433
(Peptidase_M1)
PF11838
(ERAP1_C) 		4 ILE A 898
HIS A 860
LEU A 859
ALA A 856
 None
 0.96A 5hrqE-5j6sA:
undetectable
5hrqF-5j6sA:
undetectable
5hrqJ-5j6sA:
undetectable		 5hrqE-5j6sA:
1.80
5hrqF-5j6sA:
2.61
5hrqJ-5j6sA:
2.61
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.
5jd3 LAE5

(uncultured
bacterium) 		PF13472
(Lipase_GDSL_2) 		4 ILE A 204
LEU A 189
ALA A 190
HIS A 201
 None
 0.95A 5hrqE-5jd3A:
undetectable
5hrqF-5jd3A:
undetectable
5hrqJ-5jd3A:
undetectable		 5hrqE-5jd3A:
20.51
5hrqF-5jd3A:
9.01
5hrqJ-5jd3A:
9.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5k53 ALDEHYDE
DEFORMYLATING
OXYGENASE

(Oscillatoria
sp.) 		PF11266
(Ald_deCOase) 		4 CYH A 116
ILE A 114
HIS A 147
LEU A 148
 None
STE  A 502 (-4.8A)
FE  A 501 (-3.4A)
None
 1.00A 5hrqE-5k53A:
undetectable
5hrqF-5k53A:
undetectable
5hrqJ-5k53A:
undetectable		 5hrqE-5k53A:
8.12
5hrqF-5k53A:
10.65
5hrqJ-5k53A:
10.65
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.
5kkb MANNOSYL-OLIGOSACCHA
RIDE
1,2-ALPHA-MANNOSIDAS
E IA

(Mus musculus) 		PF01532
(Glyco_hydro_47) 		4 ILE A 243
HIS A 638
LEU A 291
ALA A 294
 None
 1.00A 5hrqE-5kkbA:
undetectable
5hrqF-5kkbA:
undetectable
5hrqJ-5kkbA:
undetectable		 5hrqE-5kkbA:
6.51
5hrqF-5kkbA:
4.59
5hrqJ-5kkbA:
4.59
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.
5nn8 LYSOSOMAL
ALPHA-GLUCOSIDASE

(Homo sapiens) 		no annotation 4 ILE A 517
HIS A 584
LEU A 587
ALA A 586
 None
 0.92A 5hrqE-5nn8A:
undetectable
5hrqF-5nn8A:
undetectable
5hrqJ-5nn8A:
undetectable		 5hrqE-5nn8A:
3.47
5hrqF-5nn8A:
2.97
5hrqJ-5nn8A:
2.97
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.
5nvm EUKARYOTIC
TRANSLATION
INITIATION FACTOR 4E
TYPE 2

(Homo sapiens) 		PF01652
(IF4E) 		4 ILE A 120
HIS A 114
LEU A 115
ALA A 169
 None
 1.01A 5hrqE-5nvmA:
undetectable
5hrqF-5nvmA:
undetectable
5hrqJ-5nvmA:
undetectable		 5hrqE-5nvmA:
9.35
5hrqF-5nvmA:
12.90
5hrqJ-5nvmA:
12.90
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.
5nvr TELOMERE LENGTH
REGULATOR PROTEIN
RIF1

(Saccharomyces
cerevisiae) 		PF12231
(Rif1_N) 		4 ILE A 583
CYH A 580
HIS A 647
LEU A 648
 None
 1.00A 5hrqE-5nvrA:
undetectable
5hrqF-5nvrA:
undetectable
5hrqJ-5nvrA:
undetectable		 5hrqE-5nvrA:
2.46
5hrqF-5nvrA:
2.49
5hrqJ-5nvrA:
2.49
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.
5oqd POLYCOMB PROTEIN PCL

(Drosophila
melanogaster) 		no annotation 4 ILE B 575
HIS B 582
LEU B 581
ALA B 584
 None
 0.97A 5hrqE-5oqdB:
undetectable
5hrqF-5oqdB:
undetectable
5hrqJ-5oqdB:
undetectable		 5hrqE-5oqdB:
8.70
5hrqF-5oqdB:
18.26
5hrqJ-5oqdB:
18.26
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.
5ovo ADP-RIBOSYL-(DINITRO
GEN REDUCTASE)
HYDROLASE

(Azospirillum
brasilense) 		no annotation 4 ILE A 156
HIS A  67
LEU A  68
ALA A  71
 None
 0.87A 5hrqE-5ovoA:
undetectable
5hrqF-5ovoA:
undetectable
5hrqJ-5ovoA:
undetectable		 5hrqE-5ovoA:
7.87
5hrqF-5ovoA:
10.99
5hrqJ-5ovoA:
10.99
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.
5ux2 ALDEHYDE
DECARBONYLASE

(Synechococcus
sp. RS9917) 		no annotation 4 CYH A 110
HIS A 141
LEU A 142
ALA A 145
 None
FE  A 301 (-3.5A)
None
None
 0.81A 5hrqE-5ux2A:
undetectable
5hrqF-5ux2A:
undetectable
5hrqJ-5ux2A:
undetectable		 5hrqE-5ux2A:
undetectable
5hrqF-5ux2A:
undetectable
5hrqJ-5ux2A:
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.
5xmg UNCHARACTERIZED
PROTEIN

(Pseudomonas
aeruginosa) 		no annotation 4 ILE A 370
HIS A 295
LEU A 294
ALA A 301
 None
 0.98A 5hrqE-5xmgA:
undetectable
5hrqF-5xmgA:
undetectable
5hrqJ-5xmgA:
undetectable		 5hrqE-5xmgA:
undetectable
5hrqF-5xmgA:
undetectable
5hrqJ-5xmgA:
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.
5y3r DNA-DEPENDENT
PROTEIN KINASE
CATALYTIC SUBUNIT

(Homo sapiens) 		PF00454
(PI3_PI4_kinase)
PF02259
(FAT)
PF02260
(FATC)
PF08163
(NUC194) 		4 CYH C1128
ILE C1124
LEU C1111
ALA C1114
 None
 0.92A 5hrqE-5y3rC:
undetectable
5hrqF-5y3rC:
undetectable
5hrqJ-5y3rC:
undetectable		 5hrqE-5y3rC:
0.64
5hrqF-5y3rC:
0.84
5hrqJ-5y3rC:
0.84
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.
5y3r DNA-DEPENDENT
PROTEIN KINASE
CATALYTIC SUBUNIT

(Homo sapiens) 		PF00454
(PI3_PI4_kinase)
PF02259
(FAT)
PF02260
(FATC)
PF08163
(NUC194) 		4 ILE C 741
LEU C 734
ALA C 715
HIS C 738
 None
 0.99A 5hrqE-5y3rC:
undetectable
5hrqF-5y3rC:
undetectable
5hrqJ-5y3rC:
undetectable		 5hrqE-5y3rC:
0.64
5hrqF-5y3rC:
0.84
5hrqJ-5y3rC:
0.84
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.
5y5a KLLA0F20702P

(Kluyveromyces
lactis) 		no annotation 4 CYH A 198
ILE A 196
LEU A 225
ALA A 228
 None
 0.95A 5hrqE-5y5aA:
undetectable
5hrqF-5y5aA:
undetectable
5hrqJ-5y5aA:
undetectable		 5hrqE-5y5aA:
undetectable
5hrqF-5y5aA:
undetectable
5hrqJ-5y5aA:
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.
5yo8 TETRAPRENYL-BETA-CUR
CUMENE SYNTHASE

(Bacillus
alcalophilus) 		no annotation 4 CYH A  84
ILE A  82
LEU A 109
ALA A 112
 None
 0.91A 5hrqE-5yo8A:
undetectable
5hrqF-5yo8A:
undetectable
5hrqJ-5yo8A:
undetectable		 5hrqE-5yo8A:
undetectable
5hrqF-5yo8A:
undetectable
5hrqJ-5yo8A:
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.
5yy3 -

(-) 		no annotation 5 CYH A 152
ILE A 151
HIS A 158
LEU A 157
ALA A 161
 None
 1.37A 5hrqE-5yy3A:
undetectable
5hrqF-5yy3A:
undetectable
5hrqJ-5yy3A:
undetectable		 5hrqE-5yy3A:
undetectable
5hrqF-5yy3A:
undetectable
5hrqJ-5yy3A:
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.
6cno INTERMEDIATE
CONDUCTANCE
CALCIUM-ACTIVATED
POTASSIUM CHANNEL
PROTEIN 4

(Homo sapiens) 		no annotation 4 CYH A 267
ILE A 265
LEU A 223
ALA A 226
 None
 0.95A 5hrqE-6cnoA:
undetectable
5hrqF-6cnoA:
undetectable
5hrqJ-6cnoA:
undetectable		 5hrqE-6cnoA:
undetectable
5hrqF-6cnoA:
undetectable
5hrqJ-6cnoA:
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.
6ewl CENTROSOMAL PROTEIN
120

(Danio rerio) 		no annotation 4 CYH A  79
HIS A 112
LEU A 126
ALA A 125
 None
 1.00A 5hrqE-6ewlA:
undetectable
5hrqF-6ewlA:
undetectable
5hrqJ-6ewlA:
undetectable		 5hrqE-6ewlA:
undetectable
5hrqF-6ewlA:
undetectable
5hrqJ-6ewlA:
undetectable