SIMILAR PATTERNS OF AMINO ACIDS FOR 1OQ5_A_CELA701_2

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.
1a3q PROTEIN (NUCLEAR
FACTOR KAPPA-B P52)

(Homo sapiens) 		PF00554
(RHD_DNA_bind)
PF16179
(RHD_dimer) 		4 HIS A 107
VAL A 138
THR A 149
LEU A 117
 None
 1.45A 1oq5A-1a3qA:
0.0		 1oq5A-1a3qA:
23.75
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.
1c9l CLATHRIN

(Rattus
norvegicus) 		PF01394
(Clathrin_propel)
PF09268
(Clathrin-link) 		4 HIS A 197
VAL A 220
THR A 168
LEU A 183
 None
 1.28A 1oq5A-1c9lA:
undetectable		 1oq5A-1c9lA:
22.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1cc1 HYDROGENASE (LARGE
SUBUNIT)

(Desulfomicrobium
baculatum) 		PF00374
(NiFeSe_Hases) 		4 HIS L 498
VAL L 445
THR L 307
LEU L 300
 FE2  L 501 (-3.5A)
None
None
None
 1.44A 1oq5A-1cc1L:
0.0		 1oq5A-1cc1L:
20.08
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.
1gkp HYDANTOINASE

(Thermus sp.) 		PF01979
(Amidohydro_1) 		4 HIS A 239
VAL A 264
THR A 181
LEU A 374
 ZN  A1460 (-3.5A)
None
KCX  A 150 ( 4.3A)
None
 1.46A 1oq5A-1gkpA:
0.0		 1oq5A-1gkpA:
21.30
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.
1gvh FLAVOHEMOPROTEIN

(Escherichia
coli) 		PF00042
(Globin)
PF00175
(NAD_binding_1)
PF00970
(FAD_binding_6) 		4 HIS A 286
VAL A 290
THR A 280
LEU A 275
 None
 1.30A 1oq5A-1gvhA:
0.0		 1oq5A-1gvhA:
20.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1hux ACTIVATOR OF
(R)-2-HYDROXYGLUTARY
L-COA DEHYDRATASE

(Acidaminococcus
fermentans) 		PF01869
(BcrAD_BadFG) 		4 HIS A  98
VAL A  97
THR A 119
LEU A  83
 None
 1.42A 1oq5A-1huxA:
0.0		 1oq5A-1huxA:
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.
1hzv NITRITE REDUCTASE

(Pseudomonas
aeruginosa) 		PF02239
(Cytochrom_D1)
PF13442
(Cytochrome_CBB3) 		4 HIS A 434
VAL A 453
THR A 514
LEU A 517
 None
 1.33A 1oq5A-1hzvA:
undetectable		 1oq5A-1hzvA:
19.55
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.
1mbm CHYMOTRYPSIN-LIKE
SERINE PROTEASE

(Equine
arteritis virus) 		PF05579
(Peptidase_S32) 		4 HIS A  39
VAL A  40
THR A 146
LEU A  35
 None
 1.25A 1oq5A-1mbmA:
0.0		 1oq5A-1mbmA:
23.64
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.
1nmo HYPOTHETICAL PROTEIN
YBGI

(Escherichia
coli) 		PF01784
(NIF3) 		4 HIS A  63
VAL A  42
THR A 172
LEU A 150
 FE  A 302 (-3.7A)
None
None
None
 1.38A 1oq5A-1nmoA:
0.0		 1oq5A-1nmoA:
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.
1t34 ATRIAL NATRIURETIC
PEPTIDE RECEPTOR A

(Rattus
norvegicus) 		PF01094
(ANF_receptor) 		4 HIS A 148
VAL A 420
THR A 182
LEU A 151
 None
 1.18A 1oq5A-1t34A:
undetectable		 1oq5A-1t34A:
21.30
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.
1t6x RIBOFLAVIN
KINASE/FMN
ADENYLYLTRANSFERASE

(Thermotoga
maritima) 		PF01687
(Flavokinase)
PF06574
(FAD_syn) 		4 HIS A  15
VAL A  18
THR A  37
LEU A  34
 None
 1.42A 1oq5A-1t6xA:
undetectable		 1oq5A-1t6xA:
23.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1v8b ADENOSYLHOMOCYSTEINA
SE

(Plasmodium
falciparum) 		PF00670
(AdoHcyase_NAD)
PF05221
(AdoHcyase) 		4 HIS A 398
VAL A 402
THR A  56
LEU A  61
 ADN  A 502 ( 3.5A)
None
ADN  A 502 (-3.0A)
None
 1.35A 1oq5A-1v8bA:
undetectable		 1oq5A-1v8bA:
20.35
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.
1w66 LIPOYLTRANSFERASE

(Mycobacterium
tuberculosis) 		PF03099
(BPL_LplA_LipB) 		4 HIS A  83
VAL A  89
THR A  74
LEU A 156
 DKA  A 301 ( 4.9A)
None
None
None
 1.13A 1oq5A-1w66A:
undetectable		 1oq5A-1w66A:
21.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1x94 PUTATIVE
PHOSPHOHEPTOSE
ISOMERASE

(Vibrio cholerae) 		PF13580
(SIS_2) 		4 HIS A 164
VAL A  16
THR A 120
LEU A 144
 None
 1.25A 1oq5A-1x94A:
undetectable		 1oq5A-1x94A:
19.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2bb0 IMIDAZOLONEPROPIONAS
E

(Bacillus
subtilis) 		PF01979
(Amidohydro_1) 		4 HIS A  80
VAL A 292
THR A 180
LEU A 246
 ZN  A1601 (-3.4A)
None
None
None
 1.46A 1oq5A-2bb0A:
undetectable		 1oq5A-2bb0A:
20.94
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.
2btw ALR0975 PROTEIN

(Nostoc sp. PCC
7120) 		PF05023
(Phytochelatin) 		4 HIS A 143
VAL A 141
THR A 124
LEU A 131
 None
 1.42A 1oq5A-2btwA:
undetectable		 1oq5A-2btwA:
21.45
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.
2d1q LUCIFERIN
4-MONOOXYGENASE

(Luciola
cruciata) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		4 HIS A 223
VAL A 368
THR A 348
LEU A 344
 None
None
None
AMP  A1001 (-4.0A)
 1.38A 1oq5A-2d1qA:
undetectable		 1oq5A-2d1qA:
19.31
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.
2d1q LUCIFERIN
4-MONOOXYGENASE

(Luciola
cruciata) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		4 HIS A 223
VAL A 368
THR A 348
LEU A 420
 None
 1.43A 1oq5A-2d1qA:
undetectable		 1oq5A-2d1qA:
19.31
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.
2e6m WERNER SYNDROME
ATP-DEPENDENT
HELICASE HOMOLOG

(Mus musculus) 		PF01612
(DNA_pol_A_exo1) 		4 HIS A 107
VAL A  93
THR A 200
LEU A 205
 None
 1.29A 1oq5A-2e6mA:
undetectable		 1oq5A-2e6mA:
19.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2fge ZINC METALLOPROTEASE
(INSULINASE FAMILY)

(Arabidopsis
thaliana) 		PF00675
(Peptidase_M16)
PF05193
(Peptidase_M16_C)
PF08367
(M16C_assoc) 		4 HIS A 247
VAL A 251
THR A 126
LEU A 132
 None
 0.92A 1oq5A-2fgeA:
undetectable		 1oq5A-2fgeA:
13.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2hdw HYPOTHETICAL PROTEIN
PA2218

(Pseudomonas
aeruginosa) 		PF02129
(Peptidase_S15) 		4 HIS A 274
VAL A 108
THR A  53
LEU A  50
 None
 1.46A 1oq5A-2hdwA:
undetectable		 1oq5A-2hdwA:
22.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2hne L-FUCONATE
DEHYDRATASE

(Xanthomonas
campestris) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 HIS A  10
VAL A  38
THR A  64
LEU A  70
 None
 1.36A 1oq5A-2hneA:
undetectable		 1oq5A-2hneA:
18.04
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.
2i71 HYPOTHETICAL PROTEIN

(Sulfolobus
solfataricus) 		PF09455
(Cas_DxTHG) 		4 HIS A 109
VAL A  86
THR A 104
LEU A 136
 MG  A 402 ( 4.8A)
MG  A 402 (-3.9A)
None
None
 1.35A 1oq5A-2i71A:
undetectable		 1oq5A-2i71A:
21.60
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.
2j16 TYROSINE-PROTEIN
PHOSPHATASE YIL113W

(Saccharomyces
cerevisiae) 		PF00782
(DSPc) 		4 HIS B 139
VAL B  85
THR B  75
LEU B  80
 None
 1.30A 1oq5A-2j16B:
undetectable		 1oq5A-2j16B:
20.62
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.
2juh TELOMERE BINDING
PROTEIN TBP1

(Nicotiana
glutinosa) 		PF00249
(Myb_DNA-binding) 		4 HIS A 654
VAL A 627
THR A 597
LEU A 619
 None
 1.27A 1oq5A-2juhA:
undetectable		 1oq5A-2juhA:
18.53
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.
2nzt HEXOKINASE-2

(Homo sapiens) 		PF00349
(Hexokinase_1)
PF03727
(Hexokinase_2) 		4 HIS A 420
VAL A 416
THR A 380
LEU A 385
 None
 1.45A 1oq5A-2nztA:
undetectable		 1oq5A-2nztA:
14.69
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.
2qo3 ERYAII ERYTHROMYCIN
POLYKETIDE SYNTHASE
MODULES 3 AND 4

(Saccharopolyspora
erythraea) 		PF00109
(ketoacyl-synt)
PF00698
(Acyl_transf_1)
PF02801
(Ketoacyl-synt_C)
PF16197
(KAsynt_C_assoc) 		4 HIS A 650
VAL A 834
THR A 784
LEU A 817
 None
 1.13A 1oq5A-2qo3A:
undetectable		 1oq5A-2qo3A:
14.56
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.
2x8w METHYLGLYOXAL
SYNTHASE

(Thermus sp. GH5) 		PF02142
(MGS) 		4 HIS A   9
VAL A  92
THR A  38
LEU A  53
 MLI  A1126 (-4.5A)
None
MLI  A1126 (-3.6A)
None
 1.36A 1oq5A-2x8wA:
undetectable		 1oq5A-2x8wA:
18.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2xio PUTATIVE
DEOXYRIBONUCLEASE
TATDN1

(Homo sapiens) 		PF01026
(TatD_DNase) 		4 HIS A 174
VAL A 172
THR A  73
LEU A 144
 EDO  A1299 (-4.1A)
None
None
None
 1.27A 1oq5A-2xioA:
undetectable		 1oq5A-2xioA:
21.00
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.
2xwb COMPLEMENT C3B
ALPHA' CHAIN

(Homo sapiens) 		PF00207
(A2M)
PF01759
(NTR)
PF07677
(A2M_recep)
PF07678
(A2M_comp)
PF10569
(Thiol-ester_cl) 		4 HIS B1327
VAL B 949
THR B 883
LEU B1488
 None
 1.26A 1oq5A-2xwbB:
undetectable		 1oq5A-2xwbB:
15.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2yev CYTOCHROME C OXIDASE
POLYPEPTIDE I+III

(Thermus
thermophilus) 		PF00115
(COX1)
PF00510
(COX3) 		4 HIS A 736
VAL A 733
THR A 664
LEU A 657
 None
 1.33A 1oq5A-2yevA:
undetectable		 1oq5A-2yevA:
15.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2yev CYTOCHROME C OXIDASE
POLYPEPTIDE I+III

(Thermus
thermophilus) 		PF00115
(COX1)
PF00510
(COX3) 		4 HIS A 736
VAL A 733
THR A 664
LEU A 659
 None
 1.48A 1oq5A-2yevA:
undetectable		 1oq5A-2yevA:
15.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3fhh OUTER MEMBRANE HEME
RECEPTOR SHUA

(Shigella
dysenteriae) 		PF00593
(TonB_dep_Rec)
PF07715
(Plug) 		4 HIS A  44
VAL A 567
THR A  34
LEU A 609
 PB  A 645 (-4.4A)
None
None
None
 1.41A 1oq5A-3fhhA:
undetectable		 1oq5A-3fhhA:
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.
3gf8 PUTATIVE
POLYSACCHARIDE
BINDING PROTEINS
(DUF1812)

(Bacteroides
thetaiotaomicron) 		PF08842
(Mfa2) 		4 HIS A 204
VAL A 149
THR A 121
LEU A  72
 None
 1.34A 1oq5A-3gf8A:
undetectable		 1oq5A-3gf8A:
21.94
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.
3h0g DNA-DIRECTED RNA
POLYMERASE II
SUBUNIT RPB9

(Schizosaccharomyces
pombe) 		PF01096
(TFIIS_C)
PF02150
(RNA_POL_M_15KD) 		4 HIS I  60
VAL I  58
THR I  64
LEU I  68
 None
 1.44A 1oq5A-3h0gI:
undetectable		 1oq5A-3h0gI:
16.06
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.
3h0k UPF0200 PROTEIN
SSO1041

(Sulfolobus
solfataricus) 		PF13238
(AAA_18) 		4 HIS A  85
VAL A  88
THR A  82
LEU A 105
 None
 1.39A 1oq5A-3h0kA:
undetectable		 1oq5A-3h0kA:
19.78
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.
3i4e ISOCITRATE LYASE

(Burkholderia
pseudomallei) 		PF00463
(ICL) 		4 HIS A 181
VAL A 152
THR A 348
LEU A  66
 None
 1.18A 1oq5A-3i4eA:
undetectable		 1oq5A-3i4eA:
19.59
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.
3jrp FUSION PROTEIN OF
PROTEIN TRANSPORT
PROTEIN SEC13 AND
NUCLEOPORIN NUP145

(Saccharomyces
cerevisiae) 		PF00400
(WD40) 		4 HIS A  43
VAL A  38
THR A  26
LEU A  70
 None
 1.37A 1oq5A-3jrpA:
undetectable		 1oq5A-3jrpA:
22.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3kf3 INVERTASE

(Schwanniomyces
occidentalis) 		PF00251
(Glyco_hydro_32N)
PF08244
(Glyco_hydro_32C) 		4 HIS A 118
VAL A 116
THR A  59
LEU A  62
 None
 1.21A 1oq5A-3kf3A:
undetectable		 1oq5A-3kf3A:
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.
3kmu INTEGRIN-LINKED
KINASE

(Homo sapiens) 		PF07714
(Pkinase_Tyr) 		4 HIS A 247
VAL A 250
THR A 310
LEU A 314
 None
 1.35A 1oq5A-3kmuA:
undetectable		 1oq5A-3kmuA:
22.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3lg3 ISOCITRATE LYASE

(Yersinia pestis) 		PF00463
(ICL) 		4 HIS A 185
VAL A 156
THR A 352
LEU A  70
 None
 1.16A 1oq5A-3lg3A:
undetectable		 1oq5A-3lg3A:
21.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3llx PREDICTED AMINO ACID
ALDOLASE OR RACEMASE

(Idiomarina
loihiensis) 		PF01168
(Ala_racemase_N)
PF14031
(D-ser_dehydrat) 		4 HIS A 164
VAL A 121
THR A 166
LEU A 111
 None
 1.35A 1oq5A-3llxA:
undetectable		 1oq5A-3llxA:
21.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3lqc DNA POLYMERASE BETA

(Rattus
norvegicus) 		PF14791
(DNA_pol_B_thumb)
PF14792
(DNA_pol_B_palm) 		4 HIS B 212
VAL B 215
THR B 233
LEU B 194
 None
 1.47A 1oq5A-3lqcB:
undetectable		 1oq5A-3lqcB:
23.86
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.
3m70 TELLURITE RESISTANCE
PROTEIN TEHB HOMOLOG

(Haemophilus
influenzae) 		PF03848
(TehB)
PF09313
(DUF1971) 		4 HIS A 109
VAL A 112
THR A 106
LEU A 136
 None
 1.42A 1oq5A-3m70A:
undetectable		 1oq5A-3m70A:
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.
3my7 ALCOHOL
DEHYDROGENASE/ACETAL
DEHYDE DEHYDROGENASE

(Vibrio
parahaemolyticus) 		PF00171
(Aldedh) 		4 HIS A 438
VAL A 434
THR A 130
LEU A 125
 None
 1.48A 1oq5A-3my7A:
undetectable		 1oq5A-3my7A:
19.78
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.
3nv0 NTF2-RELATED EXPORT
PROTEIN
NUCLEAR RNA EXPORT
FACTOR 2

(Caenorhabditis
elegans) 		PF02136
(NTF2)
no annotation 		4 HIS A 337
VAL A 322
THR B 116
LEU A 326
 None
 1.19A 1oq5A-3nv0A:
undetectable		 1oq5A-3nv0A:
21.64
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.
3ob8 BETA-GALACTOSIDASE

(Kluyveromyces
lactis) 		PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N)
PF02929
(Bgal_small_N) 		4 HIS A  16
VAL A  15
THR A  22
LEU A 464
 None
 1.22A 1oq5A-3ob8A:
undetectable		 1oq5A-3ob8A:
15.46
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.
3pih UVRABC SYSTEM
PROTEIN A

(Thermotoga
maritima) 		PF00005
(ABC_tran) 		4 HIS A 852
VAL A 855
THR A 582
LEU A 585
 None
 1.20A 1oq5A-3pihA:
undetectable		 1oq5A-3pihA:
16.67
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.
3tkk PREDICTED
ACETAMIDASE/FORMAMID
ASE

(Caldanaerobacter
subterraneus) 		PF03069
(FmdA_AmdA) 		4 HIS A 244
VAL A 243
THR A 258
LEU A 264
 None
 1.37A 1oq5A-3tkkA:
undetectable		 1oq5A-3tkkA:
20.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3vsj 2-AMINO-5-CHLOROPHEN
OL 1,6-DIOXYGENASE
ALPHA SUBUNIT
2-AMINO-5-CHLOROPHEN
OL 1,6-DIOXYGENASE
BETA SUBUNIT

(Comamonas
testosteroni) 		PF02900
(LigB) 		4 HIS B  69
VAL B 116
THR B  65
LEU A 181
 None
 1.47A 1oq5A-3vsjB:
undetectable		 1oq5A-3vsjB:
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.
3wso F-BOX ONLY PROTEIN
44

(Homo sapiens) 		PF04300
(FBA)
PF12937
(F-box-like) 		4 HIS A 211
VAL A 160
THR A 190
LEU A 181
 None
 1.21A 1oq5A-3wsoA:
undetectable		 1oq5A-3wsoA:
20.98
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.
3x3y PHENYLETHYLAMINE
OXIDASE

(Arthrobacter
globiformis) 		PF01179
(Cu_amine_oxid)
PF02728
(Cu_amine_oxidN3) 		4 HIS A 170
VAL A 159
THR A 408
LEU A 156
 GOL  A 708 (-3.8A)
GOL  A 708 ( 4.7A)
None
None
 1.43A 1oq5A-3x3yA:
undetectable		 1oq5A-3x3yA:
18.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3zdb PROTEIN XNI

(Escherichia
coli) 		PF01367
(5_3_exonuc)
PF02739
(5_3_exonuc_N) 		4 HIS A 119
VAL A 114
THR A  43
LEU A   6
 None
 1.48A 1oq5A-3zdbA:
undetectable		 1oq5A-3zdbA:
24.05
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.
3zdj ENCA BETA-LACTAMASE

(synthetic
construct) 		PF13354
(Beta-lactamase2) 		4 HIS A 112
VAL A 108
THR A 118
LEU A 138
 None
 1.49A 1oq5A-3zdjA:
undetectable		 1oq5A-3zdjA:
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.
3zv8 3C PROTEASE

(Enterovirus D) 		PF00548
(Peptidase_C3) 		4 HIS A  31
VAL A  30
THR A 180
LEU A 175
 None
 1.21A 1oq5A-3zv8A:
undetectable		 1oq5A-3zv8A:
21.90
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.
4bed HEMOCYANIN KLH1

(Megathura
crenulata) 		PF00264
(Tyrosinase)
PF14830
(Haemocyan_bet_s) 		4 HIS B3182
VAL B3190
THR B3000
LEU B3054
 None
 1.10A 1oq5A-4bedB:
undetectable		 1oq5A-4bedB:
9.80
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.
4bsn EXPORTIN-1

(Homo sapiens) 		PF03810
(IBN_N)
PF08389
(Xpo1)
PF08767
(CRM1_C) 		4 HIS A 481
VAL A 484
THR A 519
LEU A 525
 None
 1.47A 1oq5A-4bsnA:
undetectable		 1oq5A-4bsnA:
12.91
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.
4f0j PROBABLE HYDROLYTIC
ENZYME

(Pseudomonas
aeruginosa) 		PF00561
(Abhydrolase_1) 		4 HIS A 141
VAL A 165
THR A 271
LEU A 292
 EDO  A 408 ( 3.7A)
None
EDO  A 407 ( 4.0A)
None
 1.41A 1oq5A-4f0jA:
undetectable		 1oq5A-4f0jA:
23.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4fbl LIPS LIPOLYTIC
ENZYME

(unidentified) 		PF12146
(Hydrolase_4) 		4 HIS A 257
VAL A 258
THR A  59
LEU A 188
 SPD  A 301 (-3.2A)
None
SPD  A 301 (-3.3A)
None
 1.03A 1oq5A-4fblA:
undetectable		 1oq5A-4fblA:
22.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4fib UNCHARACTERIZED
PROTEIN YDHK

(Bacillus
subtilis) 		PF07563
(DUF1541) 		4 HIS A 194
VAL A 180
THR A  92
LEU A 203
 None
 1.42A 1oq5A-4fibA:
undetectable		 1oq5A-4fibA:
18.53
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.
4fp4 POLYPRENYL
SYNTHETASE

(Pyrobaculum
calidifontis) 		PF00348
(polyprenyl_synt) 		4 HIS A 231
VAL A 232
THR A 186
LEU A 171
 None
 1.32A 1oq5A-4fp4A:
undetectable		 1oq5A-4fp4A:
21.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4hnh NAD-DEPENDENT
EPIMERASE/DEHYDRATAS
E

(Veillonella
parvula) 		PF13460
(NAD_binding_10) 		4 HIS A  48
VAL A  51
THR A  24
LEU A  18
 None
 1.45A 1oq5A-4hnhA:
undetectable		 1oq5A-4hnhA:
21.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ipn 6-PHOSPHO-BETA-GLUCO
SIDASE

(Streptococcus
pneumoniae) 		PF00232
(Glyco_hydro_1) 		4 HIS B 260
VAL B 259
THR B 212
LEU B 289
 None
 1.50A 1oq5A-4ipnB:
undetectable		 1oq5A-4ipnB:
20.12
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.
4ir8 SEDOHEPTULOSE-1,7
BISPHOSPHATASE,
PUTATIVE

(Toxoplasma
gondii) 		PF00316
(FBPase) 		4 HIS A 132
VAL A 152
THR A  22
LEU A  14
 None
 1.46A 1oq5A-4ir8A:
undetectable		 1oq5A-4ir8A:
22.47
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.
4j7b POLO-LIKE KINASE

(Danio rerio) 		PF00069
(Pkinase) 		4 HIS A 214
VAL A 218
THR A 185
LEU A 153
 None
 1.22A 1oq5A-4j7bA:
undetectable		 1oq5A-4j7bA:
22.26
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.
4jif INTEGRIN
BETA-1-BINDING
PROTEIN 1

(Homo sapiens) 		PF10480
(ICAP-1_inte_bdg) 		4 HIS A 131
VAL A 121
THR A 159
LEU A 135
 None
 1.50A 1oq5A-4jifA:
undetectable		 1oq5A-4jifA:
20.54
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.
4nar PUTATIVE URONATE
ISOMERASE

(Thermotoga
maritima) 		PF09861
(DUF2088) 		4 HIS A 180
VAL A 176
THR A 157
LEU A 163
 SO4  A 501 (-4.0A)
None
None
None
 1.50A 1oq5A-4narA:
undetectable		 1oq5A-4narA:
20.45
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.
4ojx 3',5'-CYCLIC-NUCLEOT
IDE
PHOSPHODIESTERASE 1

(Saccharomyces
cerevisiae) 		PF02112
(PDEase_II) 		4 HIS A 130
VAL A 223
THR A 127
LEU A 158
 ZN  A 403 ( 3.2A)
None
None
None
 1.48A 1oq5A-4ojxA:
undetectable		 1oq5A-4ojxA:
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.
4ol0 TRANSPORTIN-3

(Homo sapiens) 		PF08389
(Xpo1) 		4 HIS B 632
VAL B 626
THR B 578
LEU B 572
 None
 1.40A 1oq5A-4ol0B:
undetectable		 1oq5A-4ol0B:
13.68
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4qk3 CARBONIC ANHYDRASE 2

(Homo sapiens) 		PF00194
(Carb_anhydrase) 		4 HIS A 119
VAL A 143
THR A 200
LEU A 204
 ZN  A 301 (-3.1A)
None
None
None
 0.13A 1oq5A-4qk3A:
44.7		 1oq5A-4qk3A:
95.75
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.
4qlb PROBABLE GLYCOGEN
[STARCH] SYNTHASE

(Caenorhabditis
elegans) 		PF05693
(Glycogen_syn) 		4 HIS A 223
VAL A 276
THR A  62
LEU A 300
 None
 1.09A 1oq5A-4qlbA:
undetectable		 1oq5A-4qlbA:
16.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4rxe FARNESYL
PYROPHOSPHATE
SYNTHASE

(Trypanosoma
brucei) 		PF00348
(polyprenyl_synt) 		4 HIS A 121
VAL A 124
THR A  42
LEU A 135
 None
 1.43A 1oq5A-4rxeA:
undetectable		 1oq5A-4rxeA:
21.37
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.
5ahu FARNESYL
PYROPHOSPHATE
SYNTHASE
FARNESYL
PYROPHOSPHATE
SYNTHASE, PUTATIVE

(Trypanosoma
brucei) 		PF00348
(polyprenyl_synt)
no annotation 		4 HIS B 121
VAL B 124
THR A  42
LEU B 135
 None
 1.40A 1oq5A-5ahuB:
undetectable		 1oq5A-5ahuB:
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.
5b3f PHOSPHORIBULOKINASE/
URIDINE KINASE

(Methanospirillum
hungatei) 		PF00485
(PRK) 		4 HIS A 123
VAL A  51
THR A 127
LEU A 133
 None
 1.08A 1oq5A-5b3fA:
undetectable		 1oq5A-5b3fA:
23.01
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.
5dj4 SESTRIN-2

(Homo sapiens) 		PF04636
(PA26) 		4 HIS A 454
VAL A 455
THR A 386
LEU A 416
 LEU  A 501 (-3.8A)
LEU  A 501 ( 4.9A)
LEU  A 501 (-3.0A)
None
 1.10A 1oq5A-5dj4A:
undetectable		 1oq5A-5dj4A:
18.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5e43 BETA-LACTAMASE

(Streptosporangium
roseum) 		PF13354
(Beta-lactamase2) 		4 HIS A 113
VAL A 109
THR A 119
LEU A 139
 None
ACT  A 302 ( 4.6A)
None
None
 1.50A 1oq5A-5e43A:
undetectable		 1oq5A-5e43A:
19.81
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.
5ee0 OBG-LIKE ATPASE 1

(Oryza sativa) 		PF01926
(MMR_HSR1)
PF06071
(YchF-GTPase_C) 		4 HIS A 124
VAL A  30
THR A 149
LEU A 108
 None
 1.27A 1oq5A-5ee0A:
undetectable		 1oq5A-5ee0A:
20.65
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5ezt CARBONIC ANHYDRASE 2

(Bos taurus) 		PF00194
(Carb_anhydrase) 		4 HIS X 118
VAL X 141
THR X 198
LEU X 202
 ZN  X 301 (-3.1A)
None
None
None
 0.26A 1oq5A-5eztX:
44.3		 1oq5A-5eztX:
80.16
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.
5g5g PUTATIVE XANTHINE
DEHYDROGENASE YAGT
IRON-SULFUR-BINDING
SUBUNIT

(Escherichia
coli) 		PF00111
(Fer2)
PF01799
(Fer2_2) 		4 HIS A 126
VAL A 111
THR A  85
LEU A  92
 None
 1.16A 1oq5A-5g5gA:
undetectable		 1oq5A-5g5gA:
21.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5hx9 BETA-LACTAMASE

(Burkholderia
vietnamiensis) 		PF13354
(Beta-lactamase2) 		4 HIS A 112
VAL A 108
THR A 118
LEU A 138
 None
EDO  A 302 (-4.0A)
EDO  A 301 ( 4.9A)
None
 1.49A 1oq5A-5hx9A:
undetectable		 1oq5A-5hx9A:
20.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5i5d INNER MEMBRANE
PROTEIN YEJM

(Salmonella
enterica) 		PF00884
(Sulfatase)
PF11893
(DUF3413) 		4 HIS A 491
VAL A 494
THR A 266
LEU A 263
 None
 1.01A 1oq5A-5i5dA:
undetectable		 1oq5A-5i5dA:
19.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5imu TAT (TWIN-ARGININE
TRANSLOCATION)
PATHWAY SIGNAL
SEQUENCE CONTAINING
PROTEIN

(Mycobacterium
tuberculosis) 		no annotation 4 HIS A 364
VAL A 357
THR A 399
LEU A 374
 None
 1.34A 1oq5A-5imuA:
undetectable		 1oq5A-5imuA:
21.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5jki PUTATIVE LIPID
PHOSPHATE
PHOSPHATASE YODM

(Bacillus
subtilis) 		PF01569
(PAP2) 		4 HIS A 171
VAL A 176
THR A  50
LEU A 160
 WO4  A 300 (-2.5A)
None
None
None
 0.98A 1oq5A-5jkiA:
undetectable		 1oq5A-5jkiA:
19.08
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.
5msy GLYCOSIDE HYDROLASE

(Bacteroides
thetaiotaomicron) 		PF12904
(Collagen_bind_2)
PF13204
(DUF4038) 		4 HIS A 216
VAL A 146
THR A  61
LEU A  65
 None
None
NH3  A 504 ( 2.8A)
None
 1.21A 1oq5A-5msyA:
undetectable		 1oq5A-5msyA:
18.32
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.
5ods CLATHRIN HEAVY CHAIN
1

(Mus musculus) 		no annotation 4 HIS A 197
VAL A 220
THR A 168
LEU A 183
 None
 1.30A 1oq5A-5odsA:
undetectable		 1oq5A-5odsA:
12.99
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.
5tw7 GMP SYNTHASE
[GLUTAMINE-HYDROLYZI
NG]

(Neisseria
gonorrhoeae) 		PF00117
(GATase)
PF00958
(GMP_synt_C)
PF02540
(NAD_synthase) 		4 HIS A  89
VAL A  59
THR A  68
LEU A   9
 None
 1.49A 1oq5A-5tw7A:
undetectable		 1oq5A-5tw7A:
19.81
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.
5uj6 GLYCOSYL HYDROLASES
FAMILY 2, SUGAR
BINDING DOMAIN
PROTEIN

(Bacteroides
uniformis) 		PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N)
PF11721
(Malectin)
PF16355
(DUF4982) 		4 HIS A 186
VAL A 182
THR A 190
LEU A 105
 None
 1.30A 1oq5A-5uj6A:
undetectable		 1oq5A-5uj6A:
16.31
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.
5w3j TUBULIN BETA CHAIN

(Saccharomyces
cerevisiae) 		PF00091
(Tubulin)
PF03953
(Tubulin_C) 		4 HIS B 264
VAL B 258
THR B 166
LEU B 250
 None
 1.32A 1oq5A-5w3jB:
undetectable		 1oq5A-5w3jB:
21.88
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.
5xks THERMOSTABLE
MONOACYLGLYCEROL
LIPASE

(Geobacillus sp.
12AMOR1) 		no annotation 4 HIS A 226
VAL A 227
THR A  30
LEU A 157
 None
 1.06A 1oq5A-5xksA:
undetectable		 1oq5A-5xksA:
12.98
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.
5xww AMPHB

(Streptomyces
nodosus) 		no annotation 4 HIS A  93
VAL A  96
THR A  57
LEU A  83
 None
 1.30A 1oq5A-5xwwA:
undetectable		 1oq5A-5xwwA:
14.29