SIMILAR PATTERNS OF AMINO ACIDS FOR 1BX4_A_ADNA350_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.
1atj PEROXIDASE C1A

(Armoracia
rusticana)
PF00141
(peroxidase)
3 LEU A 166
SER A 161
ASN A 158
HEM  A 350 (-4.0A)
None
None
0.68A 1bx4A-1atjA:
undetectable
1bx4A-1atjA:
22.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1c4o DNA NUCLEOTIDE
EXCISION REPAIR
ENZYME UVRB


(Thermus
thermophilus)
PF00271
(Helicase_C)
PF04851
(ResIII)
PF12344
(UvrB)
3 LEU A 342
SER A 140
ASN A  63
None
0.70A 1bx4A-1c4oA:
0.2
1bx4A-1c4oA:
20.03
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.
1dc1 BSOBI RESTRICTION
ENDONUCLEASE


(Geobacillus
stearothermophilus)
PF09194
(Endonuc-BsobI)
3 LEU A 114
SER A  76
ASN A  96
None
0.56A 1bx4A-1dc1A:
undetectable
1bx4A-1dc1A:
21.05
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.
1jwe PROTEIN (DNAB
HELICASE)


(Escherichia
coli)
PF00772
(DnaB)
3 LEU A  42
SER A  35
ASN A 117
None
0.77A 1bx4A-1jweA:
undetectable
1bx4A-1jweA:
16.52
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.
1le8 MATING-TYPE PROTEIN
ALPHA-2


(Saccharomyces
cerevisiae)
PF00046
(Homeobox)
3 LEU B 162
SER B 172
ASN B 178
None
0.79A 1bx4A-1le8B:
undetectable
1bx4A-1le8B:
12.35
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.
1lgf P450 MONOOXYGENASE

(Amycolatopsis
orientalis)
PF00067
(p450)
3 LEU A 247
SER A 242
ASN A 240
None
None
HEM  A 430 (-3.9A)
0.82A 1bx4A-1lgfA:
undetectable
1bx4A-1lgfA:
19.90
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.
1lpj RETINOL-BINDING
PROTEIN IV, CELLULAR


(Homo sapiens)
PF00061
(Lipocalin)
3 LEU A 117
SER A  13
ASN A  15
None
0.78A 1bx4A-1lpjA:
undetectable
1bx4A-1lpjA:
14.96
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.
1sb8 WBPP

(Pseudomonas
aeruginosa)
PF01370
(Epimerase)
3 LEU A 316
SER A 311
ASN A 262
None
0.79A 1bx4A-1sb8A:
5.2
1bx4A-1sb8A:
22.25
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.
1svv THREONINE ALDOLASE

(Leishmania
major)
PF01212
(Beta_elim_lyase)
3 LEU A 191
SER A 193
ASN A 298
None
0.77A 1bx4A-1svvA:
3.7
1bx4A-1svvA:
22.83
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.
1u3d CRYPTOCHROME 1
APOPROTEIN


(Arabidopsis
thaliana)
PF00875
(DNA_photolyase)
PF03441
(FAD_binding_7)
3 LEU A 233
SER A 236
ASN A 288
None
0.59A 1bx4A-1u3dA:
2.9
1bx4A-1u3dA:
20.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1w18 LEVANSUCRASE

(Gluconacetobacter
diazotrophicus)
PF02435
(Glyco_hydro_68)
3 LEU A 139
SER A 148
ASN A 542
None
0.82A 1bx4A-1w18A:
undetectable
1bx4A-1w18A:
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.
1wj5 HYPOTHETICAL PROTEIN
(RIKEN CDNA
0610009H20)


(Mus musculus)
PF09170
(STN1_2)
3 LEU A  51
SER A  22
ASN A  82
None
0.75A 1bx4A-1wj5A:
undetectable
1bx4A-1wj5A:
18.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1wvt HYPOTHETICAL PROTEIN
ST2180


(Sulfurisphaera
tokodaii)
PF01923
(Cob_adeno_trans)
3 LEU A  46
SER A 110
ASN A 163
None
0.78A 1bx4A-1wvtA:
undetectable
1bx4A-1wvtA:
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.
1xxg ENTEROTOXIN

(Staphylococcus
aureus)
PF01123
(Stap_Strp_toxin)
PF02876
(Stap_Strp_tox_C)
3 LEU A  50
SER A  47
ASN A  68
None
0.66A 1bx4A-1xxgA:
undetectable
1bx4A-1xxgA:
19.02
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.
1yzf LIPASE/ACYLHYDROLASE

(Enterococcus
faecalis)
PF13472
(Lipase_GDSL_2)
3 LEU A 109
SER A 104
ASN A 143
None
0.72A 1bx4A-1yzfA:
3.0
1bx4A-1yzfA:
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.
2akc CLASS A NONSPECIFIC
ACID PHOSPHATASE
PHON


(Salmonella
enterica)
PF01569
(PAP2)
3 LEU A 169
SER A  88
ASN A 238
None
0.82A 1bx4A-2akcA:
undetectable
1bx4A-2akcA:
21.23
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.
2b0t NADP ISOCITRATE
DEHYDROGENASE


(Corynebacterium
glutamicum)
PF03971
(IDH)
3 LEU A  14
SER A 713
ASN A 715
None
0.77A 1bx4A-2b0tA:
undetectable
1bx4A-2b0tA:
18.05
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.
2f3o PYRUVATE
FORMATE-LYASE 2


(Archaeoglobus
fulgidus)
PF01228
(Gly_radical)
PF02901
(PFL-like)
3 LEU A 101
SER A  20
ASN A  71
None
0.68A 1bx4A-2f3oA:
undetectable
1bx4A-2f3oA:
16.69
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.
2f7l 455AA LONG
HYPOTHETICAL
PHOSPHO-SUGAR MUTASE


(Sulfurisphaera
tokodaii)
PF00408
(PGM_PMM_IV)
PF02878
(PGM_PMM_I)
PF02879
(PGM_PMM_II)
PF02880
(PGM_PMM_III)
3 LEU A 419
SER A 287
ASN A 328
None
0.70A 1bx4A-2f7lA:
undetectable
1bx4A-2f7lA:
22.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2fge ZINC METALLOPROTEASE
(INSULINASE FAMILY)


(Arabidopsis
thaliana)
PF00675
(Peptidase_M16)
PF05193
(Peptidase_M16_C)
PF08367
(M16C_assoc)
3 LEU A 511
SER A 165
ASN A 162
None
0.80A 1bx4A-2fgeA:
undetectable
1bx4A-2fgeA:
16.38
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.
2jf4 PERIPLASMIC
TREHALASE


(Escherichia
coli)
PF01204
(Trehalase)
3 LEU A 168
SER A 161
ASN A 183
None
0.73A 1bx4A-2jf4A:
undetectable
1bx4A-2jf4A:
21.61
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.
2lqn CRK-LIKE PROTEIN

(Homo sapiens)
PF00017
(SH2)
PF00018
(SH3_1)
PF07653
(SH3_2)
3 LEU A  28
SER A  59
ASN A  55
None
0.77A 1bx4A-2lqnA:
undetectable
1bx4A-2lqnA:
20.44
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.
2lsh SPORE-WALL FUNGAL
HYDROPHOBIN DEWA


(Aspergillus
nidulans)
PF01185
(Hydrophobin)
3 LEU A  50
SER A  45
ASN A  43
None
0.81A 1bx4A-2lshA:
undetectable
1bx4A-2lshA:
17.01
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.
2lwy BACTERIAL
INTEIN-LIKE DOMAIN


(Ruminiclostridium
thermocellum)
PF07591
(PT-HINT)
3 LEU A  90
SER A  92
ASN A 129
None
0.84A 1bx4A-2lwyA:
undetectable
1bx4A-2lwyA:
16.98
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.
2ok8 PUTATIVE
FERREDOXIN--NADP
REDUCTASE


(Plasmodium
falciparum)
PF00175
(NAD_binding_1)
3 LEU A 226
SER A 222
ASN A  30
None
0.75A 1bx4A-2ok8A:
4.4
1bx4A-2ok8A:
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.
2p9w MAL S 1 ALLERGENIC
PROTEIN


(Malassezia
sympodialis)
no annotation 3 LEU A 230
SER A 290
ASN A 287
None
0.67A 1bx4A-2p9wA:
undetectable
1bx4A-2p9wA:
22.08
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.
2taa TAKA-AMYLASE A

(Aspergillus
oryzae)
PF00128
(Alpha-amylase)
PF09260
(DUF1966)
3 LEU A 114
SER A 105
ASN A 197
None
0.84A 1bx4A-2taaA:
undetectable
1bx4A-2taaA:
19.28
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.
2vhe ACETYLTRANSFERASE

(Campylobacter
jejuni)
PF00132
(Hexapep)
3 LEU A 153
SER A 169
ASN A 150
None
0.82A 1bx4A-2vheA:
undetectable
1bx4A-2vheA:
21.86
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.
2wfo GLYCOPROTEIN 1

(Machupo
mammarenavirus)
PF00798
(Arena_glycoprot)
3 LEU A 132
SER A 141
ASN A 137
None
None
NAG  A1243 (-1.8A)
0.79A 1bx4A-2wfoA:
undetectable
1bx4A-2wfoA:
17.65
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.
2x3l ORN/LYS/ARG
DECARBOXYLASE FAMILY
PROTEIN


(Staphylococcus
aureus)
PF01276
(OKR_DC_1)
PF03711
(OKR_DC_1_C)
3 LEU A 222
SER A 220
ASN A  79
None
PLP  A1211 (-3.4A)
None
0.83A 1bx4A-2x3lA:
3.0
1bx4A-2x3lA:
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.
2ybx PHOSPHATIDYLINOSITOL
-5-PHOSPHATE
4-KINASE TYPE-2
ALPHA


(Homo sapiens)
PF01504
(PIP5K)
3 LEU A 122
SER A 137
ASN A 198
None
0.84A 1bx4A-2ybxA:
undetectable
1bx4A-2ybxA:
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.
3ciy TOLL-LIKE RECEPTOR 3

(Mus musculus)
PF00560
(LRR_1)
PF13855
(LRR_8)
3 LEU A 321
SER A 295
ASN A 291
None
None
NAG  A2911 (-1.9A)
0.76A 1bx4A-3ciyA:
undetectable
1bx4A-3ciyA:
20.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ctt MALTASE-GLUCOAMYLASE

(Homo sapiens)
PF00088
(Trefoil)
PF01055
(Glyco_hydro_31)
PF16863
(NtCtMGAM_N)
3 LEU A 151
SER A 230
ASN A 176
None
0.73A 1bx4A-3cttA:
undetectable
1bx4A-3cttA:
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.
3e7w D-ALANINE--POLY(PHOS
PHORIBITOL) LIGASE
SUBUNIT 1


(Bacillus
subtilis)
PF00501
(AMP-binding)
PF13193
(AMP-binding_C)
3 LEU A  27
SER A  22
ASN A 189
None
0.77A 1bx4A-3e7wA:
undetectable
1bx4A-3e7wA:
19.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3fnk CELLULOSOMAL
SCAFFOLDIN ADAPTOR
PROTEIN B


(Acetivibrio
cellulolyticus)
PF00963
(Cohesin)
3 LEU A  98
SER A  68
ASN A  66
None
0.57A 1bx4A-3fnkA:
undetectable
1bx4A-3fnkA:
20.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3fzy RTX TOXIN RTXA

(Vibrio cholerae)
PF11713
(Peptidase_C80)
3 LEU A3492
SER A3494
ASN A3438
None
0.76A 1bx4A-3fzyA:
undetectable
1bx4A-3fzyA:
21.23
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.
3gcd RTX TOXIN RTXA

(Vibrio cholerae)
PF11713
(Peptidase_C80)
3 LEU A  64
SER A  66
ASN A  10
None
0.77A 1bx4A-3gcdA:
undetectable
1bx4A-3gcdA:
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.
3gk3 ACETOACETYL-COA
REDUCTASE


(Burkholderia
pseudomallei)
PF13561
(adh_short_C2)
3 LEU A 222
SER A 183
ASN A 138
None
0.66A 1bx4A-3gk3A:
6.6
1bx4A-3gk3A:
21.25
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.
3hjr EXTRACELLULAR SERINE
PROTEASE


(Aeromonas
sobria)
PF00082
(Peptidase_S8)
PF01483
(P_proprotein)
3 LEU A 486
SER A 509
ASN A 243
None
0.78A 1bx4A-3hjrA:
undetectable
1bx4A-3hjrA:
20.60
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.
3ks7 PUTATIVE PUTATIVE
PNGASE F


(Bacteroides
fragilis)
PF09112
(N-glycanase_N)
PF09113
(N-glycanase_C)
3 LEU A 278
SER A 302
ASN A 310
None
0.83A 1bx4A-3ks7A:
undetectable
1bx4A-3ks7A:
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.
3l8q CELLULOSOMAL
SCAFFOLDIN ADAPTOR
PROTEIN B


(Acetivibrio
cellulolyticus)
PF00963
(Cohesin)
3 LEU A 261
SER A 231
ASN A 229
None
0.70A 1bx4A-3l8qA:
undetectable
1bx4A-3l8qA:
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.
3lp8 PHOSPHORIBOSYLAMINE-
GLYCINE LIGASE


(Ehrlichia
chaffeensis)
PF01071
(GARS_A)
PF02843
(GARS_C)
PF02844
(GARS_N)
3 LEU A 297
SER A 295
ASN A 383
None
0.71A 1bx4A-3lp8A:
undetectable
1bx4A-3lp8A:
21.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3m2p UDP-N-ACETYLGLUCOSAM
INE 4-EPIMERASE


(Bacillus cereus)
PF01370
(Epimerase)
3 LEU A 271
SER A 266
ASN A 120
None
0.71A 1bx4A-3m2pA:
5.7
1bx4A-3m2pA:
22.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3m2p UDP-N-ACETYLGLUCOSAM
INE 4-EPIMERASE


(Bacillus cereus)
PF01370
(Epimerase)
3 LEU A 271
SER A 266
ASN A 221
None
0.74A 1bx4A-3m2pA:
5.7
1bx4A-3m2pA:
22.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3mca ELONGATION FACTOR 1
ALPHA-LIKE PROTEIN
PROTEIN DOM34


(Schizosaccharomyces
pombe)
PF00009
(GTP_EFTU)
PF03143
(GTP_EFTU_D3)
PF03463
(eRF1_1)
PF03464
(eRF1_2)
PF03465
(eRF1_3)
3 LEU A 517
SER A 579
ASN B 254
None
0.76A 1bx4A-3mcaA:
undetectable
1bx4A-3mcaA:
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.
3mdy BONE MORPHOGENETIC
PROTEIN RECEPTOR
TYPE-1B


(Homo sapiens)
PF07714
(Pkinase_Tyr)
PF08515
(TGF_beta_GS)
3 LEU A 463
SER A 459
ASN A 455
None
0.83A 1bx4A-3mdyA:
undetectable
1bx4A-3mdyA:
21.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3obf PUTATIVE
TRANSCRIPTIONAL
REGULATOR, ICLR
FAMILY


(Paenarthrobacter
aurescens)
PF01614
(IclR)
3 LEU A 193
SER A 188
ASN A 238
None
0.65A 1bx4A-3obfA:
undetectable
1bx4A-3obfA:
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.
3p4g ANTIFREEZE PROTEIN

(Marinomonas
primoryensis)
no annotation 3 LEU A  50
SER A  47
ASN A  64
None
0.79A 1bx4A-3p4gA:
undetectable
1bx4A-3p4gA:
22.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3pyg 4-DIPHOSPHOCYTIDYL-2
-C-METHYL-D-ERYTHRIT
OL KINASE


(Mycobacterium
tuberculosis)
PF00288
(GHMP_kinases_N)
PF08544
(GHMP_kinases_C)
3 LEU A  52
SER A  90
ASN A  48
None
0.83A 1bx4A-3pygA:
undetectable
1bx4A-3pygA:
22.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3qki GLUCOSE-6-PHOSPHATE
ISOMERASE


(Plasmodium
falciparum)
PF00342
(PGI)
3 LEU A 503
SER A 433
ASN A 176
None
0.84A 1bx4A-3qkiA:
undetectable
1bx4A-3qkiA:
21.38
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.
3qtd PMBA PROTEIN

(Pseudomonas
aeruginosa)
PF01523
(PmbA_TldD)
3 LEU A 338
SER A 332
ASN A 343
None
0.76A 1bx4A-3qtdA:
undetectable
1bx4A-3qtdA:
22.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3sgg HYPOTHETICAL
HYDROLASE


(Bacteroides
thetaiotaomicron)
PF14323
(GxGYxYP_C)
PF16216
(GxGYxYP_N)
3 LEU A 427
SER A 330
ASN A 334
None
0.80A 1bx4A-3sggA:
undetectable
1bx4A-3sggA:
21.81
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.
3t1b TRANSCRIPTIONAL
REGULATOR, LYSR
FAMILY


(Vibrio cholerae)
PF00126
(HTH_1)
PF03466
(LysR_substrate)
3 LEU A 164
SER A 258
ASN A 201
None
0.75A 1bx4A-3t1bA:
undetectable
1bx4A-3t1bA:
20.42
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.
3tw8 DENN
DOMAIN-CONTAINING
PROTEIN 1B


(Homo sapiens)
PF02141
(DENN)
PF03455
(dDENN)
PF03456
(uDENN)
3 LEU A 203
SER A 201
ASN A  64
None
0.82A 1bx4A-3tw8A:
undetectable
1bx4A-3tw8A:
20.10
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.
3vth HYDROGENASE
MATURATION FACTOR


(Caldanaerobacter
subterraneus)
PF00708
(Acylphosphatase)
PF01300
(Sua5_yciO_yrdC)
PF07503
(zf-HYPF)
3 LEU A 710
SER A 700
ASN A 733
None
None
AP2  A 806 (-4.9A)
0.50A 1bx4A-3vthA:
undetectable
1bx4A-3vthA:
18.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3vzg ZYMOGEN GRANULE
MEMBRANE PROTEIN 16


(Homo sapiens)
PF01419
(Jacalin)
3 LEU A 133
SER A  23
ASN A 136
None
0.58A 1bx4A-3vzgA:
undetectable
1bx4A-3vzgA:
18.33
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.
4egt MAJOR CAPSID PROTEIN
VP60


(Rabbit
hemorrhagic
disease virus)
PF00915
(Calici_coat)
3 LEU A 547
SER A 465
ASN A 253
None
0.71A 1bx4A-4egtA:
undetectable
1bx4A-4egtA:
20.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4fb5 PROBABLE
OXIDOREDUCTASE
PROTEIN


(Rhizobium etli)
PF01408
(GFO_IDH_MocA)
PF02894
(GFO_IDH_MocA_C)
3 LEU A 239
SER A 244
ASN A 154
None
0.84A 1bx4A-4fb5A:
undetectable
1bx4A-4fb5A:
21.79
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.
4gba DCN1-LIKE PROTEIN 3

(Homo sapiens)
PF03556
(Cullin_binding)
3 LEU A 191
SER A 239
ASN A 244
None
0.78A 1bx4A-4gbaA:
undetectable
1bx4A-4gbaA:
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.
4hr6 LECTIN

(Trichosanthes
anguina)
PF00652
(Ricin_B_lectin)
3 LEU C 105
SER C 107
ASN C 115
None
0.79A 1bx4A-4hr6C:
undetectable
1bx4A-4hr6C:
19.73
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.
4j0m SERINE/THREONINE-PRO
TEIN KINASE
BRI1-LIKE 1


(Arabidopsis
thaliana)
PF08263
(LRRNT_2)
PF13516
(LRR_6)
PF13855
(LRR_8)
3 LEU A 573
SER A 569
ASN A 545
None
0.84A 1bx4A-4j0mA:
undetectable
1bx4A-4j0mA:
18.41
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.
4jcs ENOYL-COA
HYDRATASE/ISOMERASE


(Cupriavidus
metallidurans)
PF00378
(ECH_1)
3 LEU A  52
SER A  54
ASN A  18
None
0.62A 1bx4A-4jcsA:
undetectable
1bx4A-4jcsA:
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.
4jnq THIOREDOXIN
REDUCTASE


(Brucella
melitensis)
PF07992
(Pyr_redox_2)
3 LEU A 192
SER A 198
ASN A 196
None
0.80A 1bx4A-4jnqA:
undetectable
1bx4A-4jnqA:
22.80
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.
4jvs PUTATIVE
UNCHARACTERIZED
PROTEIN


(Legionella
drancourtii)
no annotation 3 LEU A 576
SER A 542
ASN A 569
ACY  A 701 ( 4.5A)
None
None
0.80A 1bx4A-4jvsA:
undetectable
1bx4A-4jvsA:
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.
4k6c ACETOACETYL-COA
REDUCTASE


(Burkholderia
cenocepacia)
PF13561
(adh_short_C2)
3 LEU A 221
SER A 182
ASN A 137
None
0.72A 1bx4A-4k6cA:
3.4
1bx4A-4k6cA:
22.25
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.
4l1f ACYL-COA
DEHYDROGENASE DOMAIN
PROTEIN


(Acidaminococcus
fermentans)
PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N)
3 LEU A  24
SER A  77
ASN A 355
None
0.74A 1bx4A-4l1fA:
undetectable
1bx4A-4l1fA:
22.75
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.
4n54 INOSITOL
DEHYDROGENASE


(Lactobacillus
casei)
PF01408
(GFO_IDH_MocA)
PF02894
(GFO_IDH_MocA_C)
3 LEU A  82
SER A  78
ASN A 175
None
NAI  A 401 (-3.1A)
None
0.78A 1bx4A-4n54A:
4.8
1bx4A-4n54A:
22.28
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.
4pph CONGLUTIN GAMMA

(Lupinus
angustifolius)
PF14541
(TAXi_C)
PF14543
(TAXi_N)
3 LEU A  27
SER A  24
ASN A 158
None
0.76A 1bx4A-4pphA:
undetectable
1bx4A-4pphA:
19.45
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.
4q6r SPHINGOSINE-1-PHOSPH
ATE LYASE 1


(Homo sapiens)
PF00282
(Pyridoxal_deC)
3 LEU A 463
SER A 482
ASN A 475
None
0.77A 1bx4A-4q6rA:
undetectable
1bx4A-4q6rA:
22.09
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.
4r04 TOXIN A

(Clostridioides
difficile)
PF11713
(Peptidase_C80)
PF12918
(TcdB_N)
PF12919
(TcdA_TcdB)
PF12920
(TcdA_TcdB_pore)
3 LEU A 799
SER A 801
ASN A1801
None
0.82A 1bx4A-4r04A:
undetectable
1bx4A-4r04A:
9.90
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.
4rav SINGLE-CHAIN FV, VL

(Homo sapiens)
PF07686
(V-set)
3 LEU B 176
SER B 192
ASN B 189
None
0.69A 1bx4A-4ravB:
undetectable
1bx4A-4ravB:
13.71
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.
4uph SULFATASE (SULFURIC
ESTER HYDROLASE)
PROTEIN


(Agrobacterium
tumefaciens)
PF00884
(Sulfatase)
PF16347
(DUF4976)
3 LEU A  89
SER A  87
ASN A  85
None
None
DDZ  A  64 ( 4.0A)
0.74A 1bx4A-4uphA:
undetectable
1bx4A-4uphA:
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.
4wi0 CELLULOSOMAL
SCAFFOLDIN ADAPTOR
PROTEIN B


(Acetivibrio
cellulolyticus)
PF00963
(Cohesin)
3 LEU A  91
SER A  61
ASN A  59
None
0.63A 1bx4A-4wi0A:
undetectable
1bx4A-4wi0A:
20.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4wui N-(5'-PHOSPHORIBOSYL
)ANTHRANILATE
ISOMERASE


(Jonesia
denitrificans)
PF00697
(PRAI)
3 LEU A 106
SER A 109
ASN A 111
None
0.79A 1bx4A-4wuiA:
undetectable
1bx4A-4wuiA:
20.75
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.
4xru HEN1

(Capnocytophaga
gingivalis)
no annotation 3 LEU C  15
SER C 160
ASN C 166
None
0.70A 1bx4A-4xruC:
3.5
1bx4A-4xruC:
23.09
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.
4yxf MUPS

(Pseudomonas
fluorescens)
PF13561
(adh_short_C2)
3 LEU A 233
SER A 195
ASN A 150
None
0.53A 1bx4A-4yxfA:
3.3
1bx4A-4yxfA:
22.84
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.
4z8t AVRRXO1-ORF1

(Xanthomonas
oryzae)
no annotation 3 LEU A 131
SER A 218
ASN A 191
None
0.78A 1bx4A-4z8tA:
undetectable
1bx4A-4z8tA:
24.61
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.
5a6s ENDOLYSIN

(Clostridium
phage phiCTP1)
PF01183
(Glyco_hydro_25)
3 LEU A  10
SER A 173
ASN A  13
None
0.77A 1bx4A-5a6sA:
undetectable
1bx4A-5a6sA:
23.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5a99 POLYHEDRIN

(Operophtera
brumata
cypovirus 19)
no annotation 3 LEU A  37
SER A 186
ASN A  62
None
0.83A 1bx4A-5a99A:
undetectable
1bx4A-5a99A:
20.11
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.
5j44 SERINE PROTEASE SEPA
AUTOTRANSPORTER


(Shigella
flexneri)
PF02395
(Peptidase_S6)
3 LEU A 859
SER A 811
ASN A 871
None
0.82A 1bx4A-5j44A:
undetectable
1bx4A-5j44A:
15.77
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.
5ke1 OUTER MEMBRANE
PROTEIN ICSA
AUTOTRANSPORTER


(Shigella
flexneri)
PF03212
(Pertactin)
PF12951
(PATR)
3 LEU A 535
SER A 530
ASN A 548
None
0.77A 1bx4A-5ke1A:
undetectable
1bx4A-5ke1A:
21.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5kzs PUTATIVE CELL
SURFACE PROTEIN,
SIMILAR TO
INTERNALIN PROTEINS


(Listeria
monocytogenes)
PF12354
(Internalin_N)
PF13855
(LRR_8)
3 LEU A  93
SER A  89
ASN A  87
None
0.58A 1bx4A-5kzsA:
undetectable
1bx4A-5kzsA:
19.95
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.
5li4 TAIL SHEATH PROTEIN

(Staphylococcus
phage 812)
no annotation 3 LEU A  62
SER A  57
ASN A  81
None
0.84A 1bx4A-5li4A:
undetectable
1bx4A-5li4A:
22.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5lpc VANADIUM-DEPENDENT
BROMOPEROXIDASE


(Acaryochloris
marina)
no annotation 3 LEU A 268
SER A 189
ASN A 556
None
0.77A 1bx4A-5lpcA:
undetectable
1bx4A-5lpcA:
18.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5m23 WD REPEAT-CONTAINING
PROTEIN 5


(Homo sapiens)
PF00400
(WD40)
3 LEU A 101
SER A  97
ASN A 138
None
0.76A 1bx4A-5m23A:
undetectable
1bx4A-5m23A:
22.54
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.
5nij VACUOLAR-PROCESSING
ENZYME GAMMA-ISOZYME


(Arabidopsis
thaliana)
no annotation 3 LEU A 183
SER A 175
ASN A  72
None
SNN  A 176 ( 3.4A)
CIT  A 502 (-3.8A)
0.82A 1bx4A-5nijA:
3.0
1bx4A-5nijA:
13.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5obt VACUOLAR-PROCESSING
ENZYME GAMMA-ISOZYME


(Arabidopsis
thaliana)
no annotation 3 LEU A 183
SER A 175
ASN A  72
None
SNN  A 176 ( 3.2A)
None
0.80A 1bx4A-5obtA:
3.1
1bx4A-5obtA:
13.35
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.
5ogl UNDECAPRENYL-DIPHOSP
HOOLIGOSACCHARIDE--P
ROTEIN
GLYCOTRANSFERASE


(Campylobacter
lari)
no annotation 3 LEU A 661
SER A 624
ASN A 620
None
0.74A 1bx4A-5oglA:
undetectable
1bx4A-5oglA:
18.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5t3a INTEGRASE

(Visna-maedi
virus)
PF00665
(rve)
3 LEU A 167
SER A 176
ASN A 172
MES  A 304 ( 4.4A)
ACT  A 301 (-3.0A)
ACT  A 301 (-4.0A)
0.74A 1bx4A-5t3aA:
undetectable
1bx4A-5t3aA:
20.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5tpv WLARA,
TDP-FUCOSE-3,4-KETOI
SOMERASE


(Campylobacter
jejuni)
PF05523
(FdtA)
3 LEU A 106
SER A  64
ASN A  99
None
0.81A 1bx4A-5tpvA:
undetectable
1bx4A-5tpvA:
17.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5tru CYTOTOXIC
T-LYMPHOCYTE PROTEIN
4


(Homo sapiens)
PF07686
(V-set)
3 LEU c  79
SER c  72
ASN c  75
None
0.81A 1bx4A-5truc:
undetectable
1bx4A-5truc:
13.95
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.
5xd7 3,6-ANHYDRO-ALPHA-L-
GALACTONATE
CYCLOISOMERASE


(Vibrio sp. EJY3)
PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C)
3 LEU A 318
SER A 308
ASN A 133
None
0.69A 1bx4A-5xd7A:
undetectable
1bx4A-5xd7A:
22.09
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.
5y8p PROBABLE
3-HYDROXYISOBUTYRATE
DEHYDROGENASE


(Mycobacterium
tuberculosis)
no annotation 3 LEU A 279
SER A 237
ASN A 242
None
0.77A 1bx4A-5y8pA:
undetectable
1bx4A-5y8pA:
13.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5zqj BETA-XYLOSIDASE

(Bacillus
pumilus)
no annotation 3 LEU A 365
SER A 355
ASN A 359
None
0.83A 1bx4A-5zqjA:
undetectable
1bx4A-5zqjA:
12.27
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.
6azt ASPARAGINYL
ENDOPEPTIDASE 1


(Helianthus
annuus)
no annotation 3 LEU A 184
SER A 176
ASN A  73
None
SNN  A 177 ( 3.5A)
None
0.78A 1bx4A-6aztA:
2.9
1bx4A-6aztA:
13.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6b5c KATANIN P60
ATPASE-CONTAINING
SUBUNIT A-LIKE 1


(Homo sapiens)
no annotation 3 LEU A 389
SER A 416
ASN A 422
None
0.67A 1bx4A-6b5cA:
undetectable
1bx4A-6b5cA:
13.85
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.
6c0b TOXIN B

(Clostridioides
difficile)
no annotation 3 LEU A1641
SER A1677
ASN A1734
None
0.72A 1bx4A-6c0bA:
undetectable
1bx4A-6c0bA:
11.21
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.
6c0m HEMAGGLUTININ-NEURAM
INIDASE


(Human
respirovirus 3)
no annotation 3 LEU A 484
SER A 510
ASN A 517
None
0.82A 1bx4A-6c0mA:
undetectable
1bx4A-6c0mA:
11.95
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.
6d95 -

(-)
no annotation 3 LEU A 471
SER A 763
ASN A 767
None
0.73A 1bx4A-6d95A:
undetectable
1bx4A-6d95A:
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.
6eoj PROTEIN CFT1

(Saccharomyces
cerevisiae)
no annotation 3 LEU A  48
SER A 504
ASN A 507
None
0.76A 1bx4A-6eojA:
undetectable
1bx4A-6eojA:
13.71