SIMILAR PATTERNS OF AMINO ACIDS FOR 3HKU_A_TORA300_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.
1h31 DIHEME CYTOCHROME C

(Rhodovulum
sulfidophilum)
no annotation 3 GLU A 242
HIS A 216
THR A 106
None
0.64A 3hkuA-1h31A:
undetectable
3hkuA-1h31A:
20.28
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.
1hm7 PENTALENENE SYNTHASE

(Streptomyces
exfoliatus)
no annotation 3 GLU A 193
HIS A 196
THR A 132
None
0.77A 3hkuA-1hm7A:
undetectable
3hkuA-1hm7A:
22.16
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1jd0 CARBONIC ANHYDRASE
XII


(Homo sapiens)
PF00194
(Carb_anhydrase)
3 GLU A 106
HIS A 119
THR A 199
ZN  A 901 ( 4.5A)
ZN  A 901 ( 3.1A)
AZM  A1400 (-3.6A)
0.09A 3hkuA-1jd0A:
36.6
3hkuA-1jd0A:
36.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1k1x 4-ALPHA-GLUCANOTRANS
FERASE


(Thermococcus
litoralis)
PF03065
(Glyco_hydro_57)
PF09094
(DUF1925)
PF09095
(DUF1926)
3 GLU A  87
HIS A  11
THR A 122
None
0.86A 3hkuA-1k1xA:
undetectable
3hkuA-1k1xA:
17.75
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1kop CARBONIC ANHYDRASE

(Neisseria
gonorrhoeae)
PF00194
(Carb_anhydrase)
3 GLU A  98
HIS A 111
THR A 177
ZN  A 301 ( 4.6A)
ZN  A 301 ( 3.2A)
AZI  A 305 (-3.4A)
0.14A 3hkuA-1kopA:
29.4
3hkuA-1kopA:
33.83
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.
1nj1 PROLINE-TRNA
SYNTHETASE


(Methanothermobacter
thermautotrophicus)
PF00587
(tRNA-synt_2b)
PF03129
(HGTP_anticodon)
PF09180
(ProRS-C_1)
3 GLU A 119
HIS A  89
THR A 117
5CA  A 512 (-3.0A)
None
5CA  A 512 (-3.5A)
0.88A 3hkuA-1nj1A:
undetectable
3hkuA-1nj1A:
19.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1nyq THREONYL-TRNA
SYNTHETASE 1


(Staphylococcus
aureus)
PF00587
(tRNA-synt_2b)
PF02824
(TGS)
PF03129
(HGTP_anticodon)
PF07973
(tRNA_SAD)
3 GLU A 359
HIS A 339
THR A 295
None
0.80A 3hkuA-1nyqA:
undetectable
3hkuA-1nyqA:
17.49
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.
1pxz MAJOR POLLEN
ALLERGEN JUN A 1


(Juniperus ashei)
PF00544
(Pec_lyase_C)
3 GLU A 264
HIS A 239
THR A 318
None
0.77A 3hkuA-1pxzA:
undetectable
3hkuA-1pxzA:
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.
1qu0 LAMININ ALPHA2 CHAIN

(Mus musculus)
PF02210
(Laminin_G_2)
3 GLU A2987
HIS A2996
THR A3075
None
0.81A 3hkuA-1qu0A:
undetectable
3hkuA-1qu0A:
25.19
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1rj6 CARBONIC ANHYDRASE
XIV


(Mus musculus)
PF00194
(Carb_anhydrase)
3 GLU A 106
HIS A 119
THR A 199
ZN  A 601 ( 4.5A)
ZN  A 601 ( 3.2A)
AZM  A 400 (-3.6A)
0.28A 3hkuA-1rj6A:
37.2
3hkuA-1rj6A:
37.31
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.
1s3i 10-FORMYLTETRAHYDROF
OLATE DEHYDROGENASE


(Rattus
norvegicus)
PF00551
(Formyl_trans_N)
PF02911
(Formyl_trans_C)
3 GLU A 201
HIS A 125
THR A 199
None
0.89A 3hkuA-1s3iA:
undetectable
3hkuA-1s3iA:
24.32
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1urt CARBONIC ANHYDRASE V

(Mus musculus)
PF00194
(Carb_anhydrase)
3 GLU A 106
HIS A 119
THR A 199
ZN  A 280 ( 4.7A)
ZN  A 280 (-3.2A)
ZN  A 280 ( 4.9A)
0.18A 3hkuA-1urtA:
36.7
3hkuA-1urtA:
51.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1vfg POLY A POLYMERASE

(Aquifex
aeolicus)
PF01743
(PolyA_pol)
3 GLU A 252
HIS A 245
THR A 322
None
0.86A 3hkuA-1vfgA:
undetectable
3hkuA-1vfgA:
22.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1vhv DIPHTHINE SYNTHASE

(Archaeoglobus
fulgidus)
PF00590
(TP_methylase)
3 GLU A  32
HIS A  91
THR A  35
None
0.78A 3hkuA-1vhvA:
undetectable
3hkuA-1vhvA:
23.08
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.
1wde PROBABLE DIPHTHINE
SYNTHASE


(Aeropyrum
pernix)
PF00590
(TP_methylase)
3 GLU A  39
HIS A 100
THR A  42
None
0.78A 3hkuA-1wdeA:
undetectable
3hkuA-1wdeA:
20.25
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.
1x6m GLUTATHIONE-DEPENDEN
T
FORMALDEHYDE-ACTIVAT
ING ENZYME


(Paracoccus
denitrificans)
PF04828
(GFA)
3 GLU A 166
HIS A   2
THR A   6
None
0.89A 3hkuA-1x6mA:
undetectable
3hkuA-1x6mA:
21.27
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1y7w HALOTOLERANT
ALPHA-TYPE CARBONIC
ANHYDRASE (DCA II)


(Dunaliella
salina)
PF00194
(Carb_anhydrase)
3 GLU A 122
HIS A 135
THR A 217
ZN  A 283 ( 4.5A)
ZN  A 283 ( 3.1A)
ACY  A 279 (-3.4A)
0.10A 3hkuA-1y7wA:
26.2
3hkuA-1y7wA:
32.05
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.
1ys4 ASPARTATE-SEMIALDEHY
DE DEHYDROGENASE


(Methanocaldococcus
jannaschii)
PF01118
(Semialdhyde_dh)
PF02774
(Semialdhyde_dhC)
3 GLU A 347
HIS A  31
THR A 284
None
0.82A 3hkuA-1ys4A:
undetectable
3hkuA-1ys4A:
21.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2a0j PTS SYSTEM, NITROGEN
REGULATORY IIA
PROTEIN


(Neisseria
meningitidis)
PF00359
(PTS_EIIA_2)
3 GLU A  36
HIS A  12
THR A  77
None
0.79A 3hkuA-2a0jA:
undetectable
3hkuA-2a0jA:
22.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2avf COPPER-CONTAINING
NITRITE REDUCTASE


(Achromobacter
cycloclastes)
PF00394
(Cu-oxidase)
PF07732
(Cu-oxidase_3)
3 GLU A 180
HIS A 245
THR A 252
None
0.77A 3hkuA-2avfA:
undetectable
3hkuA-2avfA:
25.30
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.
2b39 C3

(Bos taurus)
PF00207
(A2M)
PF01759
(NTR)
PF01821
(ANATO)
PF01835
(A2M_N)
PF07677
(A2M_recep)
PF07678
(A2M_comp)
PF07703
(A2M_N_2)
PF10569
(Thiol-ester_cl)
3 GLU A  45
HIS A  47
THR A 489
None
0.87A 3hkuA-2b39A:
undetectable
3hkuA-2b39A:
9.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ep5 350AA LONG
HYPOTHETICAL
ASPARTATE-SEMIALDEHY
DE DEHYDROGENASE


(Sulfurisphaera
tokodaii)
PF01118
(Semialdhyde_dh)
PF02774
(Semialdhyde_dhC)
3 GLU A 342
HIS A  27
THR A 279
None
0.86A 3hkuA-2ep5A:
undetectable
3hkuA-2ep5A:
20.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2fel 3-CARBOXY-CIS,CIS-MU
CONATE LACTONIZING
ENZYME


(Agrobacterium
tumefaciens)
PF00206
(Lyase_1)
3 GLU A 339
HIS A 133
THR A 137
None
0.86A 3hkuA-2felA:
undetectable
3hkuA-2felA:
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.
2ggq 401AA LONG
HYPOTHETICAL
GLUCOSE-1-PHOSPHATE
THYMIDYLYLTRANSFERAS
E


(Sulfurisphaera
tokodaii)
PF00132
(Hexapep)
PF00483
(NTP_transferase)
3 GLU A 319
HIS A 362
THR A  20
None
0.66A 3hkuA-2ggqA:
undetectable
3hkuA-2ggqA:
20.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2gv9 DNA POLYMERASE

(Human
alphaherpesvirus
1)
PF00136
(DNA_pol_B)
PF03104
(DNA_pol_B_exo1)
3 GLU A 342
HIS A 197
THR A 337
None
0.87A 3hkuA-2gv9A:
undetectable
3hkuA-2gv9A:
12.54
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.
2ice COMPLEMENT C3 BETA
CHAIN


(Homo sapiens)
PF01835
(A2M_N)
PF07703
(A2M_N_2)
3 GLU A  23
HIS A  25
THR A 469
None
0.77A 3hkuA-2iceA:
undetectable
3hkuA-2iceA:
18.85
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2it4 CARBONIC ANHYDRASE 1

(Homo sapiens)
PF00194
(Carb_anhydrase)
3 GLU A 106
HIS A 119
THR A 199
ZN  A 561 ( 4.9A)
ZN  A 561 ( 3.1A)
PPF  A 500 (-3.6A)
0.29A 3hkuA-2it4A:
40.7
3hkuA-2it4A:
60.55
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.
2jh9 VP4 CORE PROTEIN

(Bluetongue
virus)
PF05059
(Orbi_VP4)
3 GLU A  13
HIS A  73
THR A  11
None
0.77A 3hkuA-2jh9A:
undetectable
3hkuA-2jh9A:
18.44
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.
2jhq URACIL
DNA-GLYCOSYLASE


(Vibrio cholerae)
PF03167
(UDG)
3 GLU A 142
HIS A 167
THR A 124
None
0.89A 3hkuA-2jhqA:
undetectable
3hkuA-2jhqA:
20.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2p6d DIPHTHINE SYNTHASE

(Pyrococcus
horikoshii)
PF00590
(TP_methylase)
3 GLU A  33
HIS A  94
THR A  36
None
0.74A 3hkuA-2p6dA:
undetectable
3hkuA-2p6dA:
21.50
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.
2p6w PUTATIVE
GLYCOSYLTRANSFERASE
(MANNOSYLTRANSFERASE
) INVOLVED IN
GLYCOSYLATING THE
PBCV-1 MAJOR CAPSID
PROTEIN


(Paramecium
bursaria
Chlorella virus
1)
PF05637
(Glyco_transf_34)
3 GLU A 151
HIS A  54
THR A 120
None
0.77A 3hkuA-2p6wA:
undetectable
3hkuA-2p6wA:
21.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2paa PHOSPHOGLYCERATE
KINASE, TESTIS
SPECIFIC


(Mus musculus)
PF00162
(PGK)
3 GLU A 192
HIS A 390
THR A 393
None
0.84A 3hkuA-2paaA:
undetectable
3hkuA-2paaA:
19.07
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.
2qob EPHRIN RECEPTOR

(Homo sapiens)
PF07714
(Pkinase_Tyr)
3 GLU A 615
HIS A 610
THR A 690
None
0.81A 3hkuA-2qobA:
undetectable
3hkuA-2qobA:
20.23
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.
2r2p EPHRIN TYPE-A
RECEPTOR 5


(Homo sapiens)
PF07714
(Pkinase_Tyr)
PF14575
(EphA2_TM)
3 GLU A 669
HIS A 664
THR A 744
None
0.85A 3hkuA-2r2pA:
undetectable
3hkuA-2r2pA:
20.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2vmj DISSIMILATORY
COPPER-CONTAINING
NITRITE REDUCTASE


(Achromobacter
xylosoxidans)
PF00394
(Cu-oxidase)
PF07732
(Cu-oxidase_3)
3 GLU A 166
HIS A 231
THR A 238
None
0.78A 3hkuA-2vmjA:
undetectable
3hkuA-2vmjA:
23.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2vwb PUTATIVE
O-SIALOGLYCOPROTEIN
ENDOPEPTIDASE


(Methanocaldococcus
jannaschii)
PF00814
(Peptidase_M22)
PF01163
(RIO1)
3 GLU A   7
HIS A 106
THR A   9
None
ANP  A1531 (-3.4A)
None
0.87A 3hkuA-2vwbA:
undetectable
3hkuA-2vwbA:
20.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2w2j CARBONIC
ANHYDRASE-RELATED
PROTEIN


(Homo sapiens)
PF00194
(Carb_anhydrase)
3 GLU A 128
HIS A 141
THR A 223
None
CL  A 401 (-4.1A)
CL  A 401 ( 4.8A)
0.20A 3hkuA-2w2jA:
37.4
3hkuA-2w2jA:
39.19
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.
2z8z LIPASE

(Pseudomonas sp.
MIS38)
PF00353
(HemolysinCabind)
3 GLU A 122
HIS A  30
THR A 108
None
0.87A 3hkuA-2z8zA:
undetectable
3hkuA-2z8zA:
17.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2znc CARBONIC ANHYDRASE
IV


(Mus musculus)
PF00194
(Carb_anhydrase)
3 GLU A 106
HIS A 119
THR A 199
ZN  A   1 ( 4.8A)
ZN  A   1 ( 3.2A)
ZN  A   1 ( 4.7A)
0.29A 3hkuA-2zncA:
32.1
3hkuA-2zncA:
35.56
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.
3a31 PROBABLE
THREONYL-TRNA
SYNTHETASE 1


(Aeropyrum
pernix)
PF00587
(tRNA-synt_2b)
PF03129
(HGTP_anticodon)
3 GLU A 138
HIS A 115
THR A  73
None
0.80A 3hkuA-3a31A:
undetectable
3hkuA-3a31A:
19.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3b1b CARBONIC ANHYDRASE 1

(Chlamydomonas
reinhardtii)
PF00194
(Carb_anhydrase)
3 GLU A 169
HIS A 182
THR A 260
ZN  A 378 ( 4.5A)
ZN  A 378 (-3.1A)
ZN  A 378 ( 4.5A)
0.14A 3hkuA-3b1bA:
25.1
3hkuA-3b1bA:
25.45
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3da2 CARBONIC ANHYDRASE
13


(Homo sapiens)
PF00194
(Carb_anhydrase)
3 GLU A 107
HIS A 120
THR A 200
ZN  A 301 ( 4.9A)
ZN  A 301 ( 3.2A)
4MD  A 401 (-3.2A)
0.21A 3hkuA-3da2A:
42.0
3hkuA-3da2A:
60.15
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3fe4 CARBONIC ANHYDRASE 6

(Homo sapiens)
PF00194
(Carb_anhydrase)
3 GLU A 125
HIS A 138
THR A 220
MG  A 901 ( 4.4A)
MG  A 901 (-3.2A)
None
0.63A 3hkuA-3fe4A:
31.3
3hkuA-3fe4A:
34.81
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.
3gf7 GLUTACONYL-COA
DECARBOXYLASE
SUBUNIT A


([Clostridium]
symbiosum)
PF01039
(Carboxyl_trans)
3 GLU A 451
HIS A 462
THR A 453
None
0.88A 3hkuA-3gf7A:
undetectable
3hkuA-3gf7A:
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.
3h4h COPPER-CONTAINING
NITRITE REDUCTASE


(Alcaligenes
faecalis)
PF00394
(Cu-oxidase)
PF07732
(Cu-oxidase_3)
3 GLU A 180
HIS A 245
THR A 252
None
0.82A 3hkuA-3h4hA:
undetectable
3hkuA-3h4hA:
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.
3hs0 COBRA VENOM FACTOR

(Naja kaouthia)
PF01835
(A2M_N)
PF07703
(A2M_N_2)
3 GLU A  22
HIS A  24
THR A 458
None
0.80A 3hkuA-3hs0A:
undetectable
3hkuA-3hs0A:
17.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3l91 ACYL-HOMOSERINE
LACTONE ACYLASE PVDQ
SUBUNIT BETA


(Pseudomonas
aeruginosa)
PF01804
(Penicil_amidase)
3 GLU B 690
HIS B 688
THR B 659
None
0.71A 3hkuA-3l91B:
undetectable
3hkuA-3l91B:
18.25
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.
3lxu TRIPEPTIDYL-PEPTIDAS
E 2


(Drosophila
melanogaster)
PF00082
(Peptidase_S8)
PF12580
(TPPII)
PF12583
(TPPII_N)
3 GLU X 783
HIS X1016
THR X 695
None
0.82A 3hkuA-3lxuX:
undetectable
3hkuA-3lxuX:
10.85
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ml5 CARBONIC ANHYDRASE 7

(Homo sapiens)
PF00194
(Carb_anhydrase)
3 GLU A 106
HIS A 119
THR A 199
ZN  A 263 ( 4.6A)
ZN  A 263 ( 3.1A)
AZM  A 264 (-3.4A)
0.11A 3hkuA-3ml5A:
43.3
3hkuA-3ml5A:
55.60
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.
3nnm CURA

(Lyngbya
majuscula)
PF05721
(PhyH)
3 GLU A  49
HIS A 270
THR A 276
None
0.47A 3hkuA-3nnmA:
undetectable
3hkuA-3nnmA:
23.51
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.
3p6l SUGAR PHOSPHATE
ISOMERASE/EPIMERASE


(Parabacteroides
distasonis)
PF01261
(AP_endonuc_2)
3 GLU A  62
HIS A 212
THR A 131
None
CIT  A 303 (-4.6A)
None
0.74A 3hkuA-3p6lA:
undetectable
3hkuA-3p6lA:
24.25
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.
3pnu DIHYDROOROTASE

(Campylobacter
jejuni)
PF04909
(Amidohydro_2)
3 GLU A 164
HIS A  10
THR A 184
None
ZN  A 337 (-3.3A)
None
0.87A 3hkuA-3pnuA:
undetectable
3hkuA-3pnuA:
23.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3prx COBRA VENOM FACTOR

(Naja kaouthia)
PF00207
(A2M)
PF01759
(NTR)
PF01821
(ANATO)
PF01835
(A2M_N)
PF07677
(A2M_recep)
PF07678
(A2M_comp)
PF07703
(A2M_N_2)
PF10569
(Thiol-ester_cl)
3 GLU B  44
HIS B  46
THR B 480
None
0.86A 3hkuA-3prxB:
undetectable
3hkuA-3prxB:
9.93
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3q31 CARBONIC ANHYDRASE

(Aspergillus
oryzae)
PF00194
(Carb_anhydrase)
3 GLU A 129
HIS A 142
THR A 215
ZN  A   1 ( 4.7A)
ZN  A   1 ( 3.2A)
MLT  A   3 ( 4.3A)
0.20A 3hkuA-3q31A:
24.6
3hkuA-3q31A:
30.69
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.
3up6 HYPOTHETICAL PROTEIN
BACOVA_04078


(Bacteroides
ovatus)
no annotation 3 GLU A 110
HIS A  77
THR A 115
None
0.85A 3hkuA-3up6A:
undetectable
3hkuA-3up6A:
22.04
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3uyq CARBONIC ANHYDRASE 3

(Homo sapiens)
PF00194
(Carb_anhydrase)
3 GLU A 106
HIS A 119
THR A 198
ZN  A 261 ( 4.9A)
ZN  A 261 (-3.2A)
ZN  A 261 ( 4.4A)
0.17A 3hkuA-3uyqA:
41.0
3hkuA-3uyqA:
58.85
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.
3vvj OVALBUMIN

(Dromaius
novaehollandiae)
PF00079
(Serpin)
3 GLU A 337
HIS A 285
THR A 194
None
0.87A 3hkuA-3vvjA:
undetectable
3hkuA-3vvjA:
21.59
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.
4dpg LYSINE--TRNA LIGASE

(Homo sapiens)
PF00152
(tRNA-synt_2)
PF01336
(tRNA_anti-codon)
3 GLU A 317
HIS A 304
THR A 268
None
0.76A 3hkuA-4dpgA:
undetectable
3hkuA-4dpgA:
20.47
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.
4dpk MALONYL-COA/SUCCINYL
-COA REDUCTASE


(Sulfurisphaera
tokodaii)
PF01118
(Semialdhyde_dh)
PF02774
(Semialdhyde_dhC)
3 GLU A 349
HIS A  30
THR A 283
None
0.87A 3hkuA-4dpkA:
undetectable
3hkuA-4dpkA:
22.62
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.
4fo0 ACTIN-RELATED
PROTEIN 8


(Homo sapiens)
PF00022
(Actin)
3 GLU A 295
HIS A 300
THR A 527
None
0.71A 3hkuA-4fo0A:
undetectable
3hkuA-4fo0A:
18.56
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4g7a CARBONATE
DEHYDRATASE


(Sulfurihydrogenibium
sp. YO3AOP1)
PF00194
(Carb_anhydrase)
3 GLU A  95
HIS A 108
THR A 174
AZM  A 302 ( 4.6A)
ZN  A 301 ( 3.1A)
AZM  A 302 (-3.4A)
0.08A 3hkuA-4g7aA:
29.8
3hkuA-4g7aA:
34.26
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.
4hhu OR280

(synthetic
construct)
no annotation 3 GLU A 164
HIS A 166
THR A  37
None
0.89A 3hkuA-4hhuA:
undetectable
3hkuA-4hhuA:
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.
4j3b M1 FAMILY
AMINOPEPTIDASE


(Plasmodium
falciparum)
PF01433
(Peptidase_M1)
PF11940
(DUF3458)
PF17432
(DUF3458_C)
3 GLU A 554
HIS A 561
THR A 576
None
0.89A 3hkuA-4j3bA:
undetectable
3hkuA-4j3bA:
15.85
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.
4kiw 3-DEHYDROQUINATE
DEHYDRATASE


(Mycobacterium
tuberculosis)
PF01220
(DHquinase_II)
3 GLU A  99
HIS A 101
THR A  80
None
KIW  A 500 (-4.2A)
None
0.85A 3hkuA-4kiwA:
undetectable
3hkuA-4kiwA:
18.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4knk BIFUNCTIONAL
AUTOLYSIN


(Staphylococcus
aureus)
PF01510
(Amidase_2)
3 GLU A 360
HIS A 386
THR A 369
None
0.88A 3hkuA-4knkA:
undetectable
3hkuA-4knkA:
19.85
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.
4kw2 UNCHARACTERIZED
PROTEIN


(Parabacteroides
distasonis)
PF01261
(AP_endonuc_2)
3 GLU A  58
HIS A 209
THR A 128
None
0.78A 3hkuA-4kw2A:
undetectable
3hkuA-4kw2A:
22.85
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.
4lis UDP-GLUCOSE
4-EPIMERASE


(Aspergillus
nidulans)
PF16363
(GDP_Man_Dehyd)
3 GLU A 292
HIS A 245
THR A 289
None
0.89A 3hkuA-4lisA:
undetectable
3hkuA-4lisA:
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.
4po6 INTERFERON
ALPHA/BETA RECEPTOR
1
NON-RECEPTOR
TYROSINE-PROTEIN
KINASE TYK2


(Homo sapiens)
no annotation 3 GLU B 497
HIS A 474
THR A 477
None
0.63A 3hkuA-4po6B:
undetectable
3hkuA-4po6B:
9.05
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)
3 GLU A 106
HIS A 119
THR A 199
ZN  A 301 ( 4.5A)
ZN  A 301 (-3.1A)
ZN  A 301 ( 4.4A)
0.18A 3hkuA-4qk3A:
44.2
3hkuA-4qk3A:
95.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4qpc 10-FORMYLTETRAHYDROF
OLATE DEHYDROGENASE


(Danio rerio)
PF00551
(Formyl_trans_N)
PF02911
(Formyl_trans_C)
3 GLU A 201
HIS A 125
THR A 199
None
0.75A 3hkuA-4qpcA:
undetectable
3hkuA-4qpcA:
23.15
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.
4reu FERRITIN

(Escherichia
coli)
PF00210
(Ferritin)
3 GLU A  49
HIS A  46
THR A 163
None
0.84A 3hkuA-4reuA:
undetectable
3hkuA-4reuA:
17.49
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4uov CARBONATE
DEHYDRATASE


(Thermovibrio
ammonificans)
PF00194
(Carb_anhydrase)
3 GLU A 118
HIS A 131
THR A 198
AZM  A 299 ( 4.4A)
ZN  A 298 ( 3.2A)
AZM  A 299 (-3.3A)
0.10A 3hkuA-4uovA:
31.1
3hkuA-4uovA:
37.06
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.
4w87 XYLOGLUCAN-SPECIFIC
ENDO-BETA-1,4-GLUCAN
ASE


(uncultured
bacterium)
PF00150
(Cellulase)
3 GLU A 236
HIS A 291
THR A 361
None
0.60A 3hkuA-4w87A:
undetectable
3hkuA-4w87A:
18.53
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4x5s CARBONIC ANHYDRASE
(CARBONATE
DEHYDRATASE)


(Sulfurihydrogenibium
azorense)
PF00194
(Carb_anhydrase)
3 GLU A  95
HIS A 108
THR A 174
AZM  A 302 ( 4.5A)
ZN  A 301 ( 3.2A)
AZM  A 302 (-3.3A)
0.09A 3hkuA-4x5sA:
29.8
3hkuA-4x5sA:
38.41
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4xfw ALPHA-CARBONIC
ANHYDRASE


(Helicobacter
pylori)
PF00194
(Carb_anhydrase)
3 GLU A 116
HIS A 129
THR A 191
ZN  A 301 (-4.9A)
ZN  A 301 ( 3.1A)
ZN  A 301 (-4.3A)
0.36A 3hkuA-4xfwA:
26.4
3hkuA-4xfwA:
30.58
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4xix CARBONIC ANHYDRASE,
ALPHA TYPE


(Chlamydomonas
reinhardtii)
PF00194
(Carb_anhydrase)
3 GLU A 166
HIS A 179
THR A 254
2HP  A 402 ( 4.7A)
ZN  A 401 ( 3.1A)
2HP  A 402 (-2.9A)
0.21A 3hkuA-4xixA:
25.8
3hkuA-4xixA:
34.20
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.
4xmv AMINOPEPTIDASE N

(Escherichia
coli)
PF01433
(Peptidase_M1)
PF11940
(DUF3458)
PF17432
(DUF3458_C)
3 GLU A 355
HIS A 362
THR A 377
None
0.87A 3hkuA-4xmvA:
undetectable
3hkuA-4xmvA:
14.88
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4xz5 CARBONIC ANHYDRASE,
ALPHA FAMILY


(Hydrogenovibrio
crunogenus)
PF00194
(Carb_anhydrase)
3 GLU A 171
HIS A 184
THR A 252
ZN  A 401 ( 4.5A)
ZN  A 401 ( 3.1A)
BCT  A 402 (-3.7A)
0.17A 3hkuA-4xz5A:
29.6
3hkuA-4xz5A:
32.83
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.
4y4r BIFUNCTIONAL
LYSINE-SPECIFIC
DEMETHYLASE AND
HISTIDYL-HYDROXYLASE
NO66


(Homo sapiens)
PF08007
(Cupin_4)
3 GLU A 352
HIS A 414
THR A 244
None
0.65A 3hkuA-4y4rA:
undetectable
3hkuA-4y4rA:
19.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4z4l CELLOBIOSE
2-EPIMERASE


(Caldicellulosiruptor
saccharolyticus)
PF07221
(GlcNAc_2-epim)
3 GLU A 158
HIS A 112
THR A 185
None
0.84A 3hkuA-4z4lA:
undetectable
3hkuA-4z4lA:
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.
5a40 MONOBODIES
PUTATIVE FLUORIDE
ION TRANSPORTER CRCB


(Bordetella
pertussis;
Homo sapiens)
PF00041
(fn3)
PF02537
(CRCB)
3 GLU A  88
HIS E  78
THR A  39
None
0.85A 3hkuA-5a40A:
undetectable
3hkuA-5a40A:
21.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5akr COPPER-CONTAINING
NITRITE REDUCTASE


(Achromobacter
cycloclastes)
PF00394
(Cu-oxidase)
PF07732
(Cu-oxidase_3)
3 GLU A 180
HIS A 245
THR A 252
None
0.80A 3hkuA-5akrA:
undetectable
3hkuA-5akrA:
23.90
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5cjf CARBONIC ANHYDRASE
14


(Homo sapiens)
PF00194
(Carb_anhydrase)
3 GLU A 106
HIS A 119
THR A 199
ZN  A 301 ( 4.6A)
ZN  A 301 ( 3.1A)
520  A 302 (-3.4A)
0.10A 3hkuA-5cjfA:
36.9
3hkuA-5cjfA:
36.80
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.
5dll AMINOPEPTIDASE N

(Francisella
tularensis)
PF01433
(Peptidase_M1)
PF11940
(DUF3458)
PF17432
(DUF3458_C)
3 GLU A 364
HIS A 371
THR A 386
None
0.89A 3hkuA-5dllA:
undetectable
3hkuA-5dllA:
14.11
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)
3 GLU X 105
HIS X 118
THR X 197
ZN  X 301 ( 4.6A)
ZN  X 301 (-3.1A)
ZN  X 301 ( 4.4A)
0.20A 3hkuA-5eztX:
44.0
3hkuA-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.
5fgn LIPOOLIGOSACCHARIDE
PHOSPHOETHANOLAMINE
TRANSFERASE A


(Neisseria
meningitidis)
PF00884
(Sulfatase)
PF08019
(DUF1705)
3 GLU A 240
HIS A 378
THR A 280
ZN  A 603 (-1.8A)
None
ZN  A 603 ( 2.7A)
0.82A 3hkuA-5fgnA:
undetectable
3hkuA-5fgnA:
18.98
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5hpj CARBONIC ANHYDRASE

(Photobacterium
profundum)
PF00194
(Carb_anhydrase)
3 GLU A 102
HIS A 115
THR A 182
ZN  A 301 ( 4.6A)
ZN  A 301 (-3.1A)
ZN  A 301 ( 4.4A)
0.22A 3hkuA-5hpjA:
29.2
3hkuA-5hpjA:
35.45
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.
5ik8 LAMININ SUBUNIT
ALPHA-2


(Mus musculus)
PF00054
(Laminin_G_1)
PF02210
(Laminin_G_2)
3 GLU A2987
HIS A2996
THR A3075
None
0.80A 3hkuA-5ik8A:
undetectable
3hkuA-5ik8A:
22.36
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5jn9 CARBONIC ANHYDRASE 4

(Homo sapiens)
PF00194
(Carb_anhydrase)
3 GLU A 106
HIS A 119
THR A 199
ZN  A 301 ( 4.6A)
ZN  A 301 ( 3.2A)
EZL  A 302 (-3.4A)
0.09A 3hkuA-5jn9A:
33.2
3hkuA-5jn9A:
35.42
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.
5lun 2-OXOGLUTARATE-DEPEN
DENT
ETHYLENE/SUCCINATE-F
ORMING ENZYME


(Pseudomonas
savastanoi)
PF03171
(2OG-FeII_Oxy)
PF14226
(DIOX_N)
3 GLU A 142
HIS A 284
THR A 163
None
0.79A 3hkuA-5lunA:
undetectable
3hkuA-5lunA:
19.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5nuq PROBABLE
PHOSPHOLIPID-BINDING
LIPOPROTEIN MLAA


(Serratia
marcescens)
no annotation 3 GLU G 145
HIS G 205
THR G 141
None
0.88A 3hkuA-5nuqG:
undetectable
3hkuA-5nuqG:
23.90
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.
5t2u OXIDOREDUCTASE,
SHORT CHAIN
DEHYDROGENASE/REDUCT
ASE FAMILY PROTEIN


(Mycolicibacterium
smegmatis)
PF13561
(adh_short_C2)
3 GLU A 155
HIS A 138
THR A 230
None
0.56A 3hkuA-5t2uA:
undetectable
3hkuA-5t2uA:
23.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5u30 CRISPR-ASSOCIATED
ENDONUCLEASE C2C1


(Alicyclobacillus
acidoterrestris)
no annotation 3 GLU A 958
HIS A 975
THR A 575
None
A  B  10 ( 4.5A)
None
0.89A 3hkuA-5u30A:
undetectable
3hkuA-5u30A:
12.41
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.
5ubk ACYL-HOMOSERINE
LACTONE ACYLASE PVDQ


(Pseudomonas
aeruginosa)
PF01804
(Penicil_amidase)
3 GLU A 474
HIS A 472
THR A 443
None
0.72A 3hkuA-5ubkA:
undetectable
3hkuA-5ubkA:
17.67
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.
5vgm DIHYDROOROTASE

(Vibrio cholerae)
PF01979
(Amidohydro_1)
3 GLU A 172
HIS A  13
THR A 193
None
ZN  A 402 (-3.3A)
None
0.89A 3hkuA-5vgmA:
undetectable
3hkuA-5vgmA:
21.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6chd LYSINE--TRNA LIGASE

(Homo sapiens)
no annotation 3 GLU A 317
HIS A 304
THR A 268
None
0.73A 3hkuA-6chdA:
undetectable
3hkuA-6chdA:
18.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6cn0 16S RRNA
(GUANINE(1405)-N(7))
-METHYLTRANSFERASE


(Proteus
mirabilis)
no annotation 3 GLU A  74
HIS A 171
THR A 175
None
0.80A 3hkuA-6cn0A:
undetectable
3hkuA-6cn0A:
16.54
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.
6cty DIHYDROOROTASE

(Yersinia pestis)
no annotation 3 GLU A 177
HIS A  17
THR A 198
None
ZN  A 402 (-3.4A)
None
0.89A 3hkuA-6ctyA:
undetectable
3hkuA-6ctyA:
15.44
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.
6eki CARBONIC ANHYDRASE

(Persephonella
marina)
no annotation 3 GLU A 123
HIS A 136
THR A 202
ZN  A 301 ( 4.7A)
ZN  A 301 (-3.2A)
ZN  A 301 (-4.4A)
0.20A 3hkuA-6ekiA:
29.7
3hkuA-6ekiA:
16.60
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.
6fe1 CARBONIC ANHYDRASE 9

(Homo sapiens)
no annotation 3 GLU A 106
HIS A 119
THR A 199
V14  A 302 (-4.2A)
ZN  A 301 ( 3.1A)
V14  A 302 (-3.2A)
0.22A 3hkuA-6fe1A:
34.0
3hkuA-6fe1A:
14.90