SIMILAR PATTERNS OF AMINO ACIDS FOR 2BR4_E_SAME301_1

List of similar pattern of amino acids derived from ASSAM search

Hit pattern: 3D amino acid arrangements similar to known drug binding site

Query pattern: Residues from known binding site for annotated drug that match the hit pattern


(Click link on the last column to view superposed patterns of amino acids in NGL viewer)
(Note that only 3-12 residue patterns can be used for ASSAM searches)
Filter list by:
Hit Macromolecule/
Organism
Pfam Res. Interface HETATM RMSD Dali Z-score Seq. Identity (%) View Dock
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1dvp HEPATOCYTE GROWTH
FACTOR-REGULATED
TYROSINE KINASE
SUBSTRATE


(Drosophila
melanogaster)
PF00790
(VHS)
PF01363
(FYVE)
3 SER A   5
ASP A  31
CYH A  73
None
1.12A 2br4E-1dvpA:
undetectable
2br4E-1dvpA:
19.50
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.
1ek2 EPOXIDE HYDROLASE

(Mus musculus)
PF00561
(Abhydrolase_1)
PF13419
(HAD_2)
3 SER A 503
ASP A 495
CYH A 521
None
1.18A 2br4E-1ek2A:
1.3
2br4E-1ek2A:
17.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1inp INOSITOL
POLYPHOSPHATE
1-PHOSPHATASE


(Bos taurus)
PF00459
(Inositol_P)
3 SER A 318
ASP A 334
CYH A 338
None
1.13A 2br4E-1inpA:
undetectable
2br4E-1inpA:
19.32
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.
1jx7 HYPOTHETICAL PROTEIN
YCHN


(Escherichia
coli)
PF02635
(DrsE)
3 SER A  17
ASP A  44
CYH A  81
None
1.07A 2br4E-1jx7A:
undetectable
2br4E-1jx7A:
19.05
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.
1lxy ARGININE DEIMINASE

(Mycoplasma
arginini)
PF02274
(Amidinotransf)
3 SER A 285
ASP A 349
CYH A 398
None
None
CIR  A 500 (-1.7A)
1.14A 2br4E-1lxyA:
undetectable
2br4E-1lxyA:
19.51
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.
1mlz 7,8-DIAMINO-PELARGON
IC ACID
AMINOTRANSFERASE


(Escherichia
coli)
PF00202
(Aminotran_3)
3 SER A 111
ASP A 147
CYH A 155
PLP  A 430 ( 3.9A)
None
None
1.18A 2br4E-1mlzA:
2.0
2br4E-1mlzA:
21.66
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.
1nxu HYPOTHETICAL
OXIDOREDUCTASE YIAK


(Escherichia
coli)
PF02615
(Ldh_2)
3 SER A  39
ASP A 172
CYH A 136
None
0.93A 2br4E-1nxuA:
undetectable
2br4E-1nxuA:
23.05
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.
1o94 ELECTRON TRANSFER
FLAVOPROTEIN
BETA-SUBUNIT


(Methylophilus
methylotrophus)
PF01012
(ETF)
3 SER C 123
ASP C  40
CYH C  76
None
0.99A 2br4E-1o94C:
undetectable
2br4E-1o94C:
21.07
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.
1qgr PROTEIN (IMPORTIN
BETA SUBUNIT)


(Homo sapiens)
PF03810
(IBN_N)
PF13513
(HEAT_EZ)
3 SER A 421
ASP A 337
CYH A 345
None
1.03A 2br4E-1qgrA:
undetectable
2br4E-1qgrA:
14.06
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.
1s4e GALACTOKINASE

(Pyrococcus
furiosus)
PF00288
(GHMP_kinases_N)
PF08544
(GHMP_kinases_C)
PF10509
(GalKase_gal_bdg)
3 SER A   8
ASP A 151
CYH A 147
None
GLA  A 500 (-3.0A)
GLA  A 500 (-4.5A)
1.14A 2br4E-1s4eA:
undetectable
2br4E-1s4eA:
19.94
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.
1tkl COPROPORPHYRINOGEN
III OXIDASE


(Saccharomyces
cerevisiae)
PF01218
(Coprogen_oxidas)
3 SER A 238
ASP A 156
CYH A 193
None
0.94A 2br4E-1tklA:
undetectable
2br4E-1tklA:
19.38
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.
1tt4 PUTATIVE CYTOPLASMIC
PROTEIN


(Salmonella
enterica)
PF04107
(GCS2)
3 SER A 329
ASP A  68
CYH A  66
None
1.07A 2br4E-1tt4A:
undetectable
2br4E-1tt4A:
20.85
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.
1xg0 B-PHYCOERYTHRIN BETA
CHAIN


(Rhodomonas sp.
CS24)
PF00502
(Phycobilisome)
3 SER C  46
ASP C  39
CYH C 158
None
PEB  C 258 (-3.1A)
PEB  C 258 (-1.8A)
0.99A 2br4E-1xg0C:
undetectable
2br4E-1xg0C:
22.89
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.
1z05 TRANSCRIPTIONAL
REGULATOR, ROK
FAMILY


(Vibrio cholerae)
PF00480
(ROK)
3 SER A 348
ASP A 305
CYH A 287
GOL  A 414 (-3.3A)
None
None
1.04A 2br4E-1z05A:
undetectable
2br4E-1z05A:
20.37
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2br4 CEPHALOSPORIN
HYDROXYLASE CMCI


(Streptomyces
clavuligerus)
PF04989
(CmcI)
3 SER A  95
ASP A 116
CYH A 139
SAM  A 301 (-3.0A)
SAM  A 301 (-3.0A)
SAM  A 301 (-2.9A)
0.40A 2br4E-2br4A:
35.2
2br4E-2br4A:
100.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2dao TRANSCRIPTION FACTOR
ETV6


(Homo sapiens)
PF00178
(Ets)
3 SER A  20
ASP A  13
CYH A   8
None
1.08A 2br4E-2daoA:
undetectable
2br4E-2daoA:
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.
2dej PROBABLE
GALACTOKINASE


(Pyrococcus
horikoshii)
PF00288
(GHMP_kinases_N)
PF08544
(GHMP_kinases_C)
PF10509
(GalKase_gal_bdg)
3 SER A   6
ASP A 149
CYH A 145
None
GLA  A 401 (-3.1A)
GLA  A 401 (-4.6A)
1.07A 2br4E-2dejA:
undetectable
2br4E-2dejA:
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.
2f4o PEPTIDE N-GLYCANASE

(Mus musculus)
PF01841
(Transglut_core)
3 SER A 371
ASP A 332
CYH A 306
None
1.06A 2br4E-2f4oA:
undetectable
2br4E-2f4oA:
20.85
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.
2h0r NICOTINAMIDASE

(Saccharomyces
cerevisiae)
PF00857
(Isochorismatase)
3 SER A  19
ASP A  51
CYH A 167
None
ZN  A 301 (-2.6A)
None
0.91A 2br4E-2h0rA:
undetectable
2br4E-2h0rA:
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.
2h3g BIOSYNTHETIC PROTEIN

(Bacillus
anthracis)
PF03309
(Pan_kinase)
3 SER X  63
ASP X 129
CYH X 137
None
1.08A 2br4E-2h3gX:
undetectable
2br4E-2h3gX:
20.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2i7x PROTEIN CFT2

(Saccharomyces
cerevisiae)
PF16661
(Lactamase_B_6)
3 SER A 283
ASP A 249
CYH A 159
None
1.04A 2br4E-2i7xA:
1.7
2br4E-2i7xA:
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.
2j7a CYTOCHROME C NITRITE
REDUCTASE NRFA


(Desulfovibrio
vulgaris)
PF02335
(Cytochrom_C552)
3 SER A 333
ASP A 318
CYH A 352
HEM  A1002 (-2.5A)
HEM  C1004 ( 4.2A)
HEM  A1005 (-2.0A)
1.15A 2br4E-2j7aA:
undetectable
2br4E-2j7aA:
20.48
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.
2nzt HEXOKINASE-2

(Homo sapiens)
PF00349
(Hexokinase_1)
PF03727
(Hexokinase_2)
3 SER A 155
ASP A 413
CYH A 217
BG6  A1002 ( 3.4A)
BG6  A1002 (-2.6A)
None
1.13A 2br4E-2nztA:
undetectable
2br4E-2nztA:
12.31
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.
2o7p RIBOFLAVIN
BIOSYNTHESIS PROTEIN
RIBD


(Escherichia
coli)
PF00383
(dCMP_cyt_deam_1)
PF01872
(RibD_C)
3 SER A 187
ASP A 179
CYH A 361
None
0.91A 2br4E-2o7pA:
undetectable
2br4E-2o7pA:
19.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ob1 LEUCINE CARBOXYL
METHYLTRANSFERASE 1


(Saccharomyces
cerevisiae)
PF04072
(LCM)
3 SER A 254
ASP A  11
CYH A  15
None
1.12A 2br4E-2ob1A:
9.1
2br4E-2ob1A:
19.51
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.
2ogj DIHYDROOROTASE

(Agrobacterium
fabrum)
PF01979
(Amidohydro_1)
3 SER A 331
ASP A 262
CYH A 232
None
1.13A 2br4E-2ogjA:
undetectable
2br4E-2ogjA:
20.71
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.
2okx RHAMNOSIDASE B

(Bacillus sp.
GL1)
PF05592
(Bac_rhamnosid)
PF08531
(Bac_rhamnosid_N)
PF17389
(Bac_rhamnosid6H)
PF17390
(Bac_rhamnosid_C)
3 SER A 800
ASP A 579
CYH A 560
None
GOL  A3007 (-2.6A)
None
1.15A 2br4E-2okxA:
undetectable
2br4E-2okxA:
13.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2oy0 METHYLTRANSFERASE

(West Nile virus)
PF01728
(FtsJ)
3 SER A  56
ASP A 146
CYH A 180
SAH  A 301 (-3.0A)
SAH  A 301 (-4.2A)
None
0.89A 2br4E-2oy0A:
7.4
2br4E-2oy0A:
22.99
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.
2p4h VESTITONE REDUCTASE

(Medicago sativa)
PF01370
(Epimerase)
3 SER X  24
ASP X 233
CYH X 253
None
0.75A 2br4E-2p4hX:
4.1
2br4E-2p4hX:
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.
2qyv XAA-HIS DIPEPTIDASE

(Histophilus
somni)
PF01546
(Peptidase_M20)
PF07687
(M20_dimer)
3 SER A 122
ASP A 169
CYH A 435
None
ZN  A 501 (-1.9A)
None
1.16A 2br4E-2qyvA:
undetectable
2br4E-2qyvA:
18.35
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.
2vjh PHYCOERYTHRIN BETA
SUBUNIT


(Gloeobacter
violaceus)
PF00502
(Phycobilisome)
3 SER B  46
ASP B  39
CYH B 158
None
PEB  B1158 (-3.3A)
PEB  B1158 (-1.6A)
1.07A 2br4E-2vjhB:
undetectable
2br4E-2vjhB:
24.79
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.
2wa2 NON-STRUCTURAL
PROTEIN 5


(Modoc virus)
PF01728
(FtsJ)
3 SER A  57
ASP A 147
CYH A 182
SAM  A1248 ( 4.7A)
SAM  A1248 (-3.7A)
None
0.93A 2br4E-2wa2A:
7.1
2br4E-2wa2A:
21.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2wqp POLYSIALIC ACID
CAPSULE BIOSYNTHESIS
PROTEIN SIAC


(Neisseria
meningitidis)
PF03102
(NeuB)
PF08666
(SAF)
3 SER A 154
ASP A 214
CYH A 250
WQP  A1350 (-2.5A)
None
None
1.16A 2br4E-2wqpA:
undetectable
2br4E-2wqpA:
21.49
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.
2wtk STE20-RELATED KINASE
ADAPTER PROTEIN
ALPHA


(Homo sapiens)
PF00069
(Pkinase)
3 SER B 212
ASP B 157
CYH B 160
None
ANP  B 432 (-2.9A)
None
0.93A 2br4E-2wtkB:
undetectable
2br4E-2wtkB:
17.06
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.
3anv D-SERINE DEHYDRATASE

(Gallus gallus)
PF01168
(Ala_racemase_N)
PF14031
(D-ser_dehydrat)
3 SER A 226
ASP A 247
CYH A 349
None
None
ZN  A 451 (-2.3A)
1.05A 2br4E-3anvA:
undetectable
2br4E-3anvA:
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.
3bg9 PYRUVATE
CARBOXYLASE,
MITOCHONDRIAL


(Homo sapiens)
PF00682
(HMGL-like)
PF02436
(PYC_OADA)
3 SER A 576
ASP A 795
CYH A 739
None
0.93A 2br4E-3bg9A:
undetectable
2br4E-3bg9A:
16.44
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.
3cf4 ACETYL-COA
DECARBOXYLASE/SYNTHA
SE ALPHA SUBUNIT


(Methanosarcina
barkeri)
PF03063
(Prismane)
3 SER A 717
ASP A 679
CYH A 804
GOL  A 825 ( 4.9A)
None
None
1.14A 2br4E-3cf4A:
3.4
2br4E-3cf4A:
13.47
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.
3cmu PROTEIN RECA

(Escherichia
coli)
PF00154
(RecA)
3 SER A1333
ASP A1032
CYH A 116
None
1.10A 2br4E-3cmuA:
undetectable
2br4E-3cmuA:
7.87
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.
3cos ALCOHOL
DEHYDROGENASE 4


(Homo sapiens)
PF00107
(ADH_zinc_N)
PF08240
(ADH_N)
3 SER A 304
ASP A 273
CYH A 295
None
0.81A 2br4E-3cosA:
4.6
2br4E-3cosA:
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.
3hu5 ISOCHORISMATASE
FAMILY PROTEIN


(Desulfovibrio
vulgaris)
PF00857
(Isochorismatase)
3 SER A 162
ASP A  15
CYH A  82
None
1.13A 2br4E-3hu5A:
3.3
2br4E-3hu5A:
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.
3i2n WD REPEAT-CONTAINING
PROTEIN 92


(Homo sapiens)
PF00400
(WD40)
3 SER A 214
ASP A 328
CYH A 337
None
0.98A 2br4E-3i2nA:
undetectable
2br4E-3i2nA:
20.66
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.
3ikm DNA POLYMERASE
SUBUNIT GAMMA-1


(Homo sapiens)
PF00476
(DNA_pol_A)
3 SER A1067
ASP A 868
CYH A1197
None
1.15A 2br4E-3ikmA:
undetectable
2br4E-3ikmA:
11.18
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.
3jq3 LOMBRICINE KINASE

(Urechis caupo)
PF00217
(ATP-gua_Ptrans)
PF02807
(ATP-gua_PtransN)
3 SER A 164
ASP A 197
CYH A 133
None
1.17A 2br4E-3jq3A:
undetectable
2br4E-3jq3A:
21.33
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.
3lh5 TIGHT JUNCTION
PROTEIN ZO-1


(Homo sapiens)
PF00625
(Guanylate_kin)
PF07653
(SH3_2)
3 SER A 758
ASP A 655
CYH A 744
None
1.12A 2br4E-3lh5A:
undetectable
2br4E-3lh5A:
22.89
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.
3lkz NON-STRUCTURAL
PROTEIN 5


(West Nile virus)
PF01728
(FtsJ)
3 SER A  56
ASP A 146
CYH A 180
SFG  A 301 (-2.6A)
SFG  A 301 (-3.8A)
None
0.92A 2br4E-3lkzA:
6.7
2br4E-3lkzA:
19.43
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.
3llx PREDICTED AMINO ACID
ALDOLASE OR RACEMASE


(Idiomarina
loihiensis)
PF01168
(Ala_racemase_N)
PF14031
(D-ser_dehydrat)
3 SER A  36
ASP A 225
CYH A 192
None
1.15A 2br4E-3llxA:
undetectable
2br4E-3llxA:
21.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3oy2 GLYCOSYLTRANSFERASE
B736L


(Paramecium
bursaria
Chlorella virus
NY2A)
no annotation 3 SER A 290
ASP A 309
CYH A 143
None
1.13A 2br4E-3oy2A:
undetectable
2br4E-3oy2A:
17.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3phg SHIKIMATE
DEHYDROGENASE


(Helicobacter
pylori)
PF08501
(Shikimate_dh_N)
3 SER A 112
ASP A 105
CYH A  86
None
1.13A 2br4E-3phgA:
4.8
2br4E-3phgA:
24.07
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.
3q88 GLUCOSE-6-PHOSPHATE
ISOMERASE


(Francisella
tularensis)
PF00342
(PGI)
3 SER A 173
ASP A 338
CYH A 334
None
1.02A 2br4E-3q88A:
undetectable
2br4E-3q88A:
18.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3si9 DIHYDRODIPICOLINATE
SYNTHASE


(Bartonella
henselae)
PF00701
(DHDPS)
3 SER A 253
ASP A 192
CYH A 207
None
1.18A 2br4E-3si9A:
undetectable
2br4E-3si9A:
19.38
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.
3tsr RIBONUCLEASE
INHIBITOR


(Mus musculus)
PF13516
(LRR_6)
3 SER E  57
ASP E 117
CYH E 147
None
1.15A 2br4E-3tsrE:
undetectable
2br4E-3tsrE:
18.35
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.
3uj2 ENOLASE 1

(Anaerostipes
caccae)
PF00113
(Enolase_C)
PF03952
(Enolase_N)
3 SER A 278
ASP A 217
CYH A 263
None
1.00A 2br4E-3uj2A:
undetectable
2br4E-3uj2A:
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.
3v0a NTNH

(Clostridium
botulinum)
PF01742
(Peptidase_M27)
PF07953
(Toxin_R_bind_N)
PF08470
(NTNH_C)
3 SER B 258
ASP B 682
CYH B 685
None
1.08A 2br4E-3v0aB:
undetectable
2br4E-3v0aB:
9.72
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.
3v57 PHYCOERYTHRIN BETA
SUBUNIT


(Porphyridium
purpureum)
PF00502
(Phycobilisome)
3 SER B  46
ASP B  39
CYH B 158
None
PEB  B 204 (-3.3A)
PEB  B 204 ( 1.7A)
1.15A 2br4E-3v57B:
undetectable
2br4E-3v57B:
24.69
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.
3v8v RIBOSOMAL RNA LARGE
SUBUNIT
METHYLTRANSFERASE L


(Escherichia
coli)
PF01170
(UPF0020)
PF02926
(THUMP)
PF10672
(Methyltrans_SAM)
3 SER A 551
ASP A 568
CYH A 598
None
SAM  A 802 (-2.9A)
SAM  A 802 (-3.3A)
0.90A 2br4E-3v8vA:
8.8
2br4E-3v8vA:
15.04
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.
3v8v RIBOSOMAL RNA LARGE
SUBUNIT
METHYLTRANSFERASE L


(Escherichia
coli)
PF01170
(UPF0020)
PF02926
(THUMP)
PF10672
(Methyltrans_SAM)
3 SER A 551
ASP A 615
CYH A 696
None
0.99A 2br4E-3v8vA:
8.8
2br4E-3v8vA:
15.04
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.
4a14 KINESIN-LIKE PROTEIN
KIF7


(Homo sapiens)
PF00225
(Kinesin)
3 SER A 253
ASP A 329
CYH A  34
None
1.00A 2br4E-4a14A:
undetectable
2br4E-4a14A:
19.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4a2l TWO-COMPONENT SYSTEM
SENSOR HISTIDINE
KINASE/RESPONSE


(Bacteroides
thetaiotaomicron)
PF07494
(Reg_prop)
PF07495
(Y_Y_Y)
3 SER A 552
ASP A 594
CYH A 609
None
None
PGE  A1785 ( 4.2A)
1.09A 2br4E-4a2lA:
undetectable
2br4E-4a2lA:
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.
4bl0 CELL CYCLE ARREST
PROTEIN BUB3


(Saccharomyces
cerevisiae)
PF00400
(WD40)
3 SER A 212
ASP A 157
CYH A 108
None
0.90A 2br4E-4bl0A:
undetectable
2br4E-4bl0A:
20.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4cw9 THIOREDOXIN

(Entamoeba
histolytica)
PF00085
(Thioredoxin)
3 SER A  38
ASP A  57
CYH A  65
None
1.03A 2br4E-4cw9A:
undetectable
2br4E-4cw9A:
17.80
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.
4eme M18 ASPARTYL
AMINOPEPTIDASE


(Plasmodium
falciparum)
PF02127
(Peptidase_M18)
3 SER A 392
ASP A 378
CYH A  27
None
0.89A 2br4E-4emeA:
undetectable
2br4E-4emeA:
16.40
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.
4ffl PYLC

(Methanosarcina
barkeri)
PF02655
(ATP-grasp_3)
3 SER A  20
ASP A  65
CYH A  89
None
1.02A 2br4E-4fflA:
undetectable
2br4E-4fflA:
20.16
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.
4i2w PROTEIN UNC-45

(Caenorhabditis
elegans)
PF11701
(UNC45-central)
3 SER A 111
ASP A  80
CYH A  70
None
1.13A 2br4E-4i2wA:
undetectable
2br4E-4i2wA:
12.87
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.
4ix3 MSSTT7D PROTEIN

(Micromonas
commoda)
PF00069
(Pkinase)
3 SER A 402
ASP A 396
CYH A 345
None
0.95A 2br4E-4ix3A:
undetectable
2br4E-4ix3A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4jkm BETA-GLUCURONIDASE

(Clostridium
perfringens)
PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N)
3 SER A 415
ASP A 458
CYH A 496
None
1.15A 2br4E-4jkmA:
undetectable
2br4E-4jkmA:
17.22
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.
4jwh TRNA
(GUANINE(9)-N1)-METH
YLTRANSFERASE


(Schizosaccharomyces
pombe)
PF01746
(tRNA_m1G_MT)
3 SER A 114
ASP A 207
CYH A 215
None
SAH  A 401 (-3.0A)
SAH  A 401 (-3.3A)
1.03A 2br4E-4jwhA:
2.5
2br4E-4jwhA:
21.29
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.
4jxj RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE A


(Rickettsia
bellii)
PF00398
(RrnaAD)
3 SER A 266
ASP A 260
CYH A 251
None
0.99A 2br4E-4jxjA:
9.5
2br4E-4jxjA:
20.27
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.
4kqk NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE


(Salmonella
enterica)
PF02277
(DBI_PRT)
3 SER A 269
ASP A 242
CYH A 134
None
0.92A 2br4E-4kqkA:
undetectable
2br4E-4kqkA:
19.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4lad E3 UBIQUITIN-PROTEIN
LIGASE AMFR


(Homo sapiens)
PF13639
(zf-RING_2)
3 SER B 363
ASP B 340
CYH B 344
None
OXL  B 703 (-4.9A)
None
1.10A 2br4E-4ladB:
undetectable
2br4E-4ladB:
17.15
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.
4lmx CRYPTOPHYTE
PHYCOERYTHRIN (BETA
CHAIN)


(Hemiselmis
andersenii)
PF00502
(Phycobilisome)
3 SER B  46
ASP B  39
CYH B 158
None
PEB  B 202 (-3.3A)
PEB  B 202 (-1.8A)
0.86A 2br4E-4lmxB:
undetectable
2br4E-4lmxB:
23.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4n6s C-PHYCOCYANIN BETA
SUBUNIT


(Thermosynechococcus
vulcanus)
PF00502
(Phycobilisome)
3 SER B  46
ASP B  39
CYH B 155
None
CYC  B 202 (-3.0A)
CYC  B 202 (-1.8A)
1.12A 2br4E-4n6sB:
undetectable
2br4E-4n6sB:
21.72
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.
4nzj PUTATIVE
ALPHA-GALACTOSIDASE


(Bacteroides
fragilis)
PF05345
(He_PIG)
PF10632
(He_PIG_assoc)
PF16499
(Melibiase_2)
3 SER A  59
ASP A 400
CYH A 375
None
0.86A 2br4E-4nzjA:
undetectable
2br4E-4nzjA:
19.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4peq RIBONUCLEASE/ANGIOGE
NIN INHIBITOR 1


(Bos taurus)
PF13516
(LRR_6)
3 SER B  57
ASP B 117
CYH B 147
None
1.12A 2br4E-4peqB:
undetectable
2br4E-4peqB:
19.69
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.
4r94 NON-STRUCTURAL
PROTEIN NS1


(Rodent
protoparvovirus
1)
PF12433
(PV_NSP1)
3 SER A  70
ASP A  91
CYH A 128
None
0.99A 2br4E-4r94A:
undetectable
2br4E-4r94A:
21.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4twr NAD BINDING
SITE:NAD-DEPENDENT
EPIMERASE/DEHYDRATAS
E:UDP-GLUCOSE
4-EPIMERASE


(Brucella
abortus)
PF01370
(Epimerase)
3 SER A 309
ASP A 224
CYH A 120
None
1.04A 2br4E-4twrA:
5.2
2br4E-4twrA:
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.
4uaq PROTEIN TRANSLOCASE
SUBUNIT SECA 2


(Mycobacterium
tuberculosis)
PF01043
(SecA_PP_bind)
PF07516
(SecA_SW)
PF07517
(SecA_DEAD)
3 SER A  31
ASP A 105
CYH A 381
None
1.12A 2br4E-4uaqA:
2.2
2br4E-4uaqA:
15.35
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.
4zkt BOTULINUM NEUROTOXIN
TYPE E,
NONTOXIC-NONHEMAGGLU
TININ COMPONENT,
NTNH


(Clostridium
botulinum)
PF01742
(Peptidase_M27)
PF07953
(Toxin_R_bind_N)
PF08470
(NTNH_C)
3 SER B 225
ASP B 647
CYH B 650
None
0.96A 2br4E-4zktB:
undetectable
2br4E-4zktB:
11.80
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.
5a22 VESICULAR STOMATITIS
VIRUS L POLYMERASE


(Vesicular
stomatitis
virus)
PF00946
(Mononeg_RNA_pol)
PF14314
(Methyltrans_Mon)
PF14318
(Mononeg_mRNAcap)
3 SER A1515
ASP A1372
CYH A1414
None
0.97A 2br4E-5a22A:
9.0
2br4E-5a22A:
7.77
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.
5b13 PHYCOERYTHRIN BETA
SUBUNIT


(Palmaria
palmata)
PF00502
(Phycobilisome)
3 SER G  46
ASP G  39
CYH G 158
None
CYC  G 202 (-3.2A)
CYC  G 202 (-1.7A)
1.09A 2br4E-5b13G:
undetectable
2br4E-5b13G:
21.22
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.
5c92 KELCH
DOMAIN-CONTAINING
PROTEIN


(Colletotrichum
graminicola)
PF01344
(Kelch_1)
PF09118
(DUF1929)
3 SER A 127
ASP A 202
CYH A 162
None
NAG  A 502 (-3.2A)
None
0.95A 2br4E-5c92A:
undetectable
2br4E-5c92A:
18.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5e4m HYDROXYNITRILE LYASE

(Davallia
tyermannii)
no annotation 3 SER A 119
ASP A  85
CYH A  73
HBA  A 201 ( 4.1A)
None
HBA  A 201 ( 4.4A)
1.13A 2br4E-5e4mA:
undetectable
2br4E-5e4mA:
25.20
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.
5e9w MRNA CAP GUANINE-N7
METHYLTRANSFERASE


(Homo sapiens)
PF03291
(Pox_MCEL)
3 SER A 262
ASP A 203
CYH A 236
SAH  A 500 (-4.1A)
SAH  A 500 ( 4.8A)
None
1.17A 2br4E-5e9wA:
9.0
2br4E-5e9wA:
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.
5h64 SERINE/THREONINE-PRO
TEIN KINASE MTOR


(Homo sapiens)
PF00454
(PI3_PI4_kinase)
PF02259
(FAT)
PF02260
(FATC)
PF08771
(FRB_dom)
PF11865
(DUF3385)
3 SER A 922
ASP A 911
CYH A1593
None
0.96A 2br4E-5h64A:
undetectable
2br4E-5h64A:
6.56
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.
5k50 L-THREONINE
3-DEHYDROGENASE


(Trypanosoma
brucei)
no annotation 3 SER A1019
ASP A1035
CYH A1056
None
NAD  A1401 (-2.8A)
NAD  A1401 (-3.7A)
0.83A 2br4E-5k50A:
4.9
2br4E-5k50A:
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.
5m5p PRE-MRNA-SPLICING
HELICASE BRR2


(Saccharomyces
cerevisiae)
PF00270
(DEAD)
PF00271
(Helicase_C)
PF02889
(Sec63)
3 SER A 733
ASP A 881
CYH A 701
None
0.99A 2br4E-5m5pA:
2.5
2br4E-5m5pA:
8.45
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.
5n28 METHYL-COENZYME M
REDUCTASE SUBUNIT
ALPHA


(Methanotorris
formicicus)
PF02249
(MCR_alpha)
PF02745
(MCR_alpha_N)
3 SER A 414
ASP A 347
CYH A 386
None
1.00A 2br4E-5n28A:
undetectable
2br4E-5n28A:
19.05
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.
5n7y ANTI-SIGMA-G FACTOR
GIN


(Bacillus
subtilis)
no annotation 3 SER A  39
ASP A  32
CYH A  14
None
None
ZN  A 101 (-2.3A)
1.15A 2br4E-5n7yA:
undetectable
2br4E-5n7yA:
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.
5nit GLUCOSE OXIDASE

(Aspergillus
niger)
no annotation 3 SER A  96
ASP A 548
CYH A 521
FAD  A 601 ( 4.1A)
FAD  A 601 (-4.5A)
None
1.07A 2br4E-5nitA:
undetectable
2br4E-5nitA:
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.
5ntf AMINOPEPTIDASE

(Trypanosoma
cruzi)
PF00883
(Peptidase_M17)
3 SER A 160
ASP A 121
CYH A 116
None
0.96A 2br4E-5ntfA:
undetectable
2br4E-5ntfA:
19.01
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.
5o5c PUTATIVE
DECARBOXYLASE
INVOLVED IN
DESFERRIOXAMINE
BIOSYNTHESIS


(Erwinia
amylovora)
no annotation 3 SER A 216
ASP A 325
CYH A 301
PLP  A 601 ( 3.9A)
PLP  A 601 (-3.0A)
None
1.18A 2br4E-5o5cA:
2.6
2br4E-5o5cA:
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.
5olj DIPEPTIDYL PEPTIDASE
IV


(Porphyromonas
gingivalis)
PF00326
(Peptidase_S9)
PF00930
(DPPIV_N)
3 SER A 394
ASP A 542
CYH A 540
None
0.99A 2br4E-5oljA:
undetectable
2br4E-5oljA:
15.32
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.
5t3j INOSITOL
MONOPHOSPHATASE


(Medicago
truncatula)
PF00459
(Inositol_P)
3 SER A 323
ASP A 209
CYH A 207
None
1.16A 2br4E-5t3jA:
undetectable
2br4E-5t3jA:
24.00
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.
5t5i TUNGSTEN
FORMYLMETHANOFURAN
DEHYDROGENASE
SUBUNIT B
TUNGSTEN-CONTAINING
FORMYLMETHANOFURAN
DEHYDROGENASE 2
SUBUNIT C


(Methanothermobacter
sp. CaT2;
Methanothermobacter
wolfeii)
PF00384
(Molybdopterin)
PF01493
(GXGXG)
3 SER C 115
ASP B 328
CYH B 309
None
1.15A 2br4E-5t5iC:
undetectable
2br4E-5t5iC:
19.06
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.
5tiw SULFOTRANSFERASE

(Schistosoma
haematobium)
no annotation 3 SER A 132
ASP A 100
CYH A 104
A3P  A 301 (-2.5A)
OAQ  A 302 (-2.5A)
None
1.16A 2br4E-5tiwA:
undetectable
2br4E-5tiwA:
19.20
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.
5u8z CAROTENOID OXYGENASE
1


(Neurospora
crassa)
PF03055
(RPE65)
3 SER A 167
ASP A 217
CYH A 266
None
1.16A 2br4E-5u8zA:
undetectable
2br4E-5u8zA:
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.
5uc7 ADENOSYLMETHIONINE-8
-AMINO-7-OXONONANOAT
E AMINOTRANSFERASE


(environmental
samples)
PF00202
(Aminotran_3)
3 SER A 111
ASP A 147
CYH A 155
LLP  A 274 ( 4.1A)
None
None
1.11A 2br4E-5uc7A:
2.4
2br4E-5uc7A:
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.
5vha DEAH
(ASP-GLU-ALA-HIS)
BOX POLYPEPTIDE 36


(Bos taurus)
no annotation 3 SER A 814
ASP A 970
CYH A 979
None
1.00A 2br4E-5vhaA:
3.5
2br4E-5vhaA:
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.
5x5h CYSTATHIONINE
BETA-LYASES/CYSTATHI
ONINE
GAMMA-SYNTHASES


(Corynebacterium
glutamicum)
PF01053
(Cys_Met_Meta_PP)
3 SER A  14
ASP A 259
CYH A 262
None
0.92A 2br4E-5x5hA:
undetectable
2br4E-5x5hA:
21.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5xtd NADH DEHYDROGENASE
[UBIQUINONE] 1 ALPHA
SUBCOMPLEX SUBUNIT
10, MITOCHONDRIAL


(Homo sapiens)
PF06212
(GRIM-19)
3 SER w 113
ASP w 223
CYH w  67
None
1.11A 2br4E-5xtdw:
undetectable
2br4E-5xtdw:
22.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6cvq APRATAXIN

(Homo sapiens)
no annotation 3 SER A 174
ASP A 193
CYH A 272
AMP  A 401 (-2.2A)
AMP  A 401 (-2.2A)
BME  A 404 (-2.7A)
1.03A 2br4E-6cvqA:
undetectable
2br4E-6cvqA:
undetectable