SIMILAR PATTERNS OF AMINO ACIDS FOR 4CEV_C_GAIC409_0

List of similar pattern of amino acids derived from ASSAM search

Hit pattern: 3D amino acid arrangements similar to known drug binding site
Query pattern: Residues from known binding site for annotated drug that match the hit pattern

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

(Abrus
precatorius) 		PF00161
(RIP) 		4 MET A 191
ASP A 188
ARG A 174
LEU A 194
 None
 1.26A 4cevA-1abrA:
undetectable
4cevC-1abrA:
undetectable		 4cevA-1abrA:
24.13
4cevC-1abrA:
24.13
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.
1dlm CATECHOL
1,2-DIOXYGENASE

(Acinetobacter
sp. ADP1) 		PF00775
(Dioxygenase_C)
PF04444
(Dioxygenase_N) 		4 MET A  88
ASP A  89
ARG A 103
HIS A  82
 None
 1.36A 4cevA-1dlmA:
undetectable
4cevC-1dlmA:
undetectable		 4cevA-1dlmA:
23.37
4cevC-1dlmA:
23.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1f82 BOTULINUM NEUROTOXIN
TYPE B

(Clostridium
botulinum) 		PF01742
(Peptidase_M27) 		4 ASP A 120
ARG A 122
HIS A 179
GLU A 184
 None
 1.25A 4cevA-1f82A:
undetectable
4cevC-1f82A:
undetectable		 4cevA-1f82A:
20.62
4cevC-1f82A:
20.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ny5 TRANSCRIPTIONAL
REGULATOR (NTRC
FAMILY)

(Aquifex
aeolicus) 		PF00072
(Response_reg)
PF00158
(Sigma54_activat) 		4 MET A 146
ASP A 316
ARG A 313
GLU A 315
 None
 1.39A 4cevA-1ny5A:
undetectable
4cevC-1ny5A:
undetectable		 4cevA-1ny5A:
23.75
4cevC-1ny5A:
23.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1oyp RIBONUCLEASE PH

(Bacillus
subtilis) 		PF01138
(RNase_PH)
PF03725
(RNase_PH_C) 		4 ASP A   4
HIS A   3
GLU A 180
LEU A 173
 None
 1.44A 4cevA-1oypA:
undetectable
4cevC-1oypA:
undetectable		 4cevA-1oypA:
24.61
4cevC-1oypA:
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.
1r6a GENOME POLYPROTEIN

(Dengue virus) 		PF01728
(FtsJ) 		4 ASP A 255
ARG A  38
GLU A 253
LEU A 210
 None
SO4  A 903 (-3.8A)
SO4  A 907 ( 4.7A)
None
 1.30A 4cevA-1r6aA:
undetectable
4cevC-1r6aA:
undetectable		 4cevA-1r6aA:
20.69
4cevC-1r6aA:
20.69
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.
1tkp IRON-RICH
DPSA-HOMOLOG PROTEIN

(Halobacterium
salinarum) 		PF00210
(Ferritin) 		4 MET A  22
ASP A  23
ARG A  26
LEU A  88
 None
 1.35A 4cevA-1tkpA:
undetectable
4cevC-1tkpA:
undetectable		 4cevA-1tkpA:
21.96
4cevC-1tkpA:
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.
1woi AGMATINASE

(Deinococcus
radiodurans) 		PF00491
(Arginase) 		4 ASP A 280
ARG A 284
GLU A 286
LEU A 275
 None
 1.45A 4cevA-1woiA:
32.4
4cevC-1woiA:
32.5		 4cevA-1woiA:
29.41
4cevC-1woiA:
29.41
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.
1yf8 BETA-GALACTOSIDE-SPE
CIFIC LECTIN 4

(Viscum album) 		PF00161
(RIP) 		4 MET A 186
ASP A 183
ARG A 169
LEU A 189
 None
 1.05A 4cevA-1yf8A:
undetectable
4cevC-1yf8A:
undetectable		 4cevA-1yf8A:
24.06
4cevC-1yf8A:
24.06
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.
2c11 MEMBRANE COPPER
AMINE OXIDASE

(Homo sapiens) 		PF01179
(Cu_amine_oxid)
PF02727
(Cu_amine_oxidN2)
PF02728
(Cu_amine_oxidN3) 		4 MET A 544
ASP A 543
ARG A 585
LEU A 562
 None
 1.47A 4cevA-2c11A:
undetectable
4cevC-2c11A:
undetectable		 4cevA-2c11A:
16.53
4cevC-2c11A:
16.53
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2cev PROTEIN (ARGINASE)

([Bacillus]
caldovelox) 		PF00491
(Arginase) 		4 ARG A 249
HIS A 252
GLU A 256
LEU A 298
 None
GAI  A1001 (-4.9A)
GAI  A1001 (-2.9A)
GAI  A1001 (-4.5A)
 0.17A 4cevA-2cevA:
57.7
4cevC-2cevA:
58.0		 4cevA-2cevA:
100.00
4cevC-2cevA:
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.
2dlu INAD-LIKE PROTEIN

(Homo sapiens) 		PF00595
(PDZ) 		4 ASP A  61
ARG A  96
HIS A  62
LEU A  64
 None
 1.22A 4cevA-2dluA:
undetectable
4cevC-2dluA:
undetectable		 4cevA-2dluA:
17.29
4cevC-2dluA:
17.29
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.
2e0z VIRUS-LIKE PARTICLE

(Pyrococcus
furiosus) 		PF04454
(Linocin_M18) 		4 ASP A 310
ARG A 138
GLU A 329
LEU A 131
 None
 1.13A 4cevA-2e0zA:
undetectable
4cevC-2e0zA:
undetectable		 4cevA-2e0zA:
23.81
4cevC-2e0zA:
23.81
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.
2gp4 6-PHOSPHOGLUCONATE
DEHYDRATASE

(Shewanella
oneidensis) 		PF00920
(ILVD_EDD) 		4 ASP A 322
ARG A  11
GLU A 595
LEU A 422
 None
 1.43A 4cevA-2gp4A:
undetectable
4cevC-2gp4A:
undetectable		 4cevA-2gp4A:
19.49
4cevC-2gp4A:
19.49
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.
2jtv PROTEIN OF UNKNOWN
FUNCTION

(Rhodopseudomonas
palustris) 		no annotation 4 ASP A  12
ARG A  20
HIS A  14
LEU A  40
 None
 1.50A 4cevA-2jtvA:
undetectable
4cevC-2jtvA:
undetectable		 4cevA-2jtvA:
11.90
4cevC-2jtvA:
11.90
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.
2p5t PUTATIVE
TRANSCRIPTIONAL
REGULATOR PEZA
PEZT

(Streptococcus
pneumoniae;
Streptococcus
pneumoniae) 		no annotation
PF06414
(Zeta_toxin) 		4 ASP B  66
ARG B  69
GLU A  84
LEU B 161
 None
 1.25A 4cevA-2p5tB:
2.3
4cevC-2p5tB:
3.3		 4cevA-2p5tB:
21.23
4cevC-2p5tB:
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.
2rgt FUSION OF
LIM/HOMEOBOX PROTEIN
LHX3, LINKER,
INSULIN GENE
ENHANCER PROTEIN
ISL-1

(Mus musculus;
synthetic
construct) 		PF00412
(LIM) 		4 MET A 137
ASP A 139
ARG A 141
LEU A 136
 None
 0.99A 4cevA-2rgtA:
undetectable
4cevC-2rgtA:
undetectable		 4cevA-2rgtA:
18.51
4cevC-2rgtA:
18.51
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.
2uw2 RIBONUCLEOSIDE-DIPHO
SPHATE REDUCTASE M2
SUBUNIT

(Homo sapiens) 		PF00268
(Ribonuc_red_sm) 		4 ASP A 138
HIS A 269
GLU A 232
LEU A 145
 None
FE  A1351 (-3.5A)
FE  A1351 (-3.4A)
None
 1.44A 4cevA-2uw2A:
undetectable
4cevC-2uw2A:
undetectable		 4cevA-2uw2A:
22.41
4cevC-2uw2A:
22.41
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.
2vq9 RNASE 1

(Danio rerio) 		PF00074
(RnaseA) 		4 ASP A  43
ARG A  94
HIS A  95
LEU A  89
 None
 1.29A 4cevA-2vq9A:
undetectable
4cevC-2vq9A:
undetectable		 4cevA-2vq9A:
18.69
4cevC-2vq9A:
18.69
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.
2wxu PHOSPHOLIPASE C

(Clostridium
perfringens) 		PF00882
(Zn_dep_PLPC)
PF01477
(PLAT) 		4 ASP A 242
ARG A 238
HIS A 241
GLU A 245
 None
None
CD  A1376 (-3.4A)
CD  A1376 (-2.2A)
 1.22A 4cevA-2wxuA:
undetectable
4cevC-2wxuA:
undetectable		 4cevA-2wxuA:
20.78
4cevC-2wxuA:
20.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2xvg ALPHA XYLOSIDASE

(Cellvibrio
japonicus) 		PF01055
(Glyco_hydro_31)
PF16338
(DUF4968)
PF17137
(DUF5110) 		4 ASP A 582
ARG A 642
HIS A 740
LEU A 640
 None
 1.48A 4cevA-2xvgA:
undetectable
4cevC-2xvgA:
undetectable		 4cevA-2xvgA:
15.12
4cevC-2xvgA:
15.12
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.
2y9x POLYPHENOL OXIDASE

(Agaricus
bisporus) 		PF00264
(Tyrosinase) 		4 ASP A 300
ARG A  95
HIS A  94
LEU A 255
 None
None
CU  A 400 (-3.2A)
None
 1.23A 4cevA-2y9xA:
undetectable
4cevC-2y9xA:
undetectable		 4cevA-2y9xA:
20.45
4cevC-2y9xA:
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.
2yr5 PRO-ENZYME OF
L-PHENYLALANINE
OXIDASE

(Pseudomonas sp.
P-501) 		no annotation 4 ASP A  35
ARG A 329
HIS A  33
LEU A 239
 None
 1.22A 4cevA-2yr5A:
undetectable
4cevC-2yr5A:
undetectable		 4cevA-2yr5A:
18.36
4cevC-2yr5A:
18.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3b0h NITRITE REDUCTASE

(Nicotiana
tabacum) 		PF01077
(NIR_SIR)
PF03460
(NIR_SIR_ferr) 		4 MET A 247
ASP A 342
GLU A 338
LEU A 260
 None
 1.43A 4cevA-3b0hA:
undetectable
4cevC-3b0hA:
undetectable		 4cevA-3b0hA:
22.88
4cevC-3b0hA:
22.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3g6e 50S RIBOSOMAL
PROTEIN L22P

(Haloarcula
marismortui) 		PF00237
(Ribosomal_L22) 		4 MET R  17
ASP R 142
ARG R  19
LEU R  91
 G  0 501 ( 4.8A)
None
G  0 500 ( 4.3A)
None
 1.46A 4cevA-3g6eR:
undetectable
4cevC-3g6eR:
undetectable		 4cevA-3g6eR:
21.15
4cevC-3g6eR:
21.15
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.
3gcz POLYPROTEIN

(Yokose virus) 		PF01728
(FtsJ) 		4 ASP A 257
ARG A  38
GLU A 255
LEU A 212
 None
SO4  A 268 (-3.9A)
None
None
 1.24A 4cevA-3gczA:
undetectable
4cevC-3gczA:
undetectable		 4cevA-3gczA:
24.49
4cevC-3gczA:
24.49
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.
3hpf MUCONATE
CYCLOISOMERASE

(Oceanobacillus
iheyensis) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 ASP A 384
ARG A 136
HIS A 137
GLU A 142
 None
 1.45A 4cevA-3hpfA:
undetectable
4cevC-3hpfA:
undetectable		 4cevA-3hpfA:
20.65
4cevC-3hpfA:
20.65
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.
3i12 D-ALANINE-D-ALANINE
LIGASE A

(Salmonella
enterica) 		PF01820
(Dala_Dala_lig_N)
PF07478
(Dala_Dala_lig_C) 		4 ASP A 302
ARG A 300
GLU A 228
LEU A 249
 None
None
ADP  A 365 (-2.9A)
ADP  A 365 (-4.4A)
 1.27A 4cevA-3i12A:
undetectable
4cevC-3i12A:
undetectable		 4cevA-3i12A:
22.11
4cevC-3i12A:
22.11
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.
3l7g XAA-PRO DIPEPTIDASE

(Alteromonas sp.) 		PF00557
(Peptidase_M24) 		4 ASP A 298
ARG A 302
HIS A 300
LEU A 334
 None
 1.33A 4cevA-3l7gA:
undetectable
4cevC-3l7gA:
undetectable		 4cevA-3l7gA:
21.99
4cevC-3l7gA:
21.99
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.
3m0e TRANSCRIPTIONAL
REGULATOR (NTRC
FAMILY)

(Aquifex
aeolicus) 		PF00158
(Sigma54_activat) 		4 MET A 146
ASP A 316
ARG A 313
GLU A 315
 None
 1.40A 4cevA-3m0eA:
4.0
4cevC-3m0eA:
undetectable		 4cevA-3m0eA:
25.38
4cevC-3m0eA:
25.38
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.
3m49 TRANSKETOLASE

(Bacillus
anthracis) 		PF00456
(Transketolase_N)
PF02779
(Transket_pyr)
PF02780
(Transketolase_C) 		4 ASP A 112
ARG A  59
HIS A  49
LEU A  77
 None
 1.21A 4cevA-3m49A:
undetectable
4cevC-3m49A:
undetectable		 4cevA-3m49A:
21.12
4cevC-3m49A:
21.12
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.
3mmk FUSION OF
LIM/HOMEOBOX PROTEIN
LHX4, LINKER,
INSULIN GENE
ENHANCER PROTEIN
ISL-2

(Mus musculus) 		PF00412
(LIM) 		4 MET A 133
ASP A 135
ARG A 137
LEU A 132
 None
 1.00A 4cevA-3mmkA:
undetectable
4cevC-3mmkA:
undetectable		 4cevA-3mmkA:
21.31
4cevC-3mmkA:
21.31
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.
3nom GLUTAMINE
CYCLOTRANSFERASE

(Zymomonas
mobilis) 		PF05096
(Glu_cyclase_2) 		4 MET A 141
ASP A 143
ARG A 149
LEU A 177
 None
 1.23A 4cevA-3nomA:
undetectable
4cevC-3nomA:
undetectable		 4cevA-3nomA:
22.04
4cevC-3nomA:
22.04
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.
3otn SUSD SUPERFAMILY
PROTEIN

(Parabacteroides
distasonis) 		PF07980
(SusD_RagB)
PF14322
(SusD-like_3) 		4 ASP A 441
ARG A 325
GLU A 445
LEU A 262
 None
 1.38A 4cevA-3otnA:
undetectable
4cevC-3otnA:
undetectable		 4cevA-3otnA:
20.59
4cevC-3otnA:
20.59
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.
3psg PEPSINOGEN

(Sus scrofa) 		PF00026
(Asp)
PF07966
(A1_Propeptide) 		4 ASP A  11
ARG A  13
GLU A  13
LEU A 276
 None
 1.17A 4cevA-3psgA:
undetectable
4cevC-3psgA:
undetectable		 4cevA-3psgA:
21.24
4cevC-3psgA:
21.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3rhg PUTATIVE
PHOPHOTRIESTERASE

(Proteus
mirabilis) 		PF02126
(PTE) 		4 MET A 254
ASP A 253
HIS A  25
GLU A  24
 BEZ  A 369 ( 3.9A)
None
ZN  A 367 ( 3.2A)
None
 1.30A 4cevA-3rhgA:
undetectable
4cevC-3rhgA:
1.4		 4cevA-3rhgA:
23.82
4cevC-3rhgA:
23.82
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.
3sma FRBF

(Streptomyces
rubellomurinus) 		PF02522
(Antibiotic_NAT) 		4 MET A 237
ASP A 233
ARG A 278
HIS A 277
 None
 1.30A 4cevA-3smaA:
undetectable
4cevC-3smaA:
undetectable		 4cevA-3smaA:
24.31
4cevC-3smaA:
24.31
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.
3ui7 CAMP AND
CAMP-INHIBITED CGMP
3',5'-CYCLIC
PHOSPHODIESTERASE
10A

(Homo sapiens) 		PF00233
(PDEase_I) 		4 ASP A 566
ARG A 520
HIS A 567
LEU A 582
 None
 1.35A 4cevA-3ui7A:
undetectable
4cevC-3ui7A:
undetectable		 4cevA-3ui7A:
20.17
4cevC-3ui7A:
20.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3w6q TYROSINASE

(Aspergillus
oryzae) 		PF00264
(Tyrosinase) 		4 ASP A 376
ARG A 104
HIS A 103
LEU A 324
 None
 1.21A 4cevA-3w6qA:
undetectable
4cevC-3w6qA:
undetectable		 4cevA-3w6qA:
18.87
4cevC-3w6qA:
18.87
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.
3zgj 4-HYDROXYPHENYLPYRUV
IC ACID DIOXYGENASE

(Streptomyces
coelicolor) 		PF00903
(Glyoxalase)
PF14696
(Glyoxalase_5) 		4 ASP A  94
ARG A 142
HIS A 143
LEU A 145
 None
 1.44A 4cevA-3zgjA:
undetectable
4cevC-3zgjA:
undetectable		 4cevA-3zgjA:
25.97
4cevC-3zgjA:
25.97
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.
3zuq BOTULINUM NEUROTOXIN
TYPE B

(Clostridium
botulinum) 		PF01742
(Peptidase_M27)
PF07952
(Toxin_trans) 		4 ASP A 121
ARG A 123
HIS A 180
GLU A 185
 None
 1.21A 4cevA-3zuqA:
undetectable
4cevC-3zuqA:
undetectable		 4cevA-3zuqA:
16.30
4cevC-3zuqA:
16.30
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.
4a14 KINESIN-LIKE PROTEIN
KIF7

(Homo sapiens) 		PF00225
(Kinesin) 		4 ASP A 329
HIS A  31
GLU A  26
LEU A  22
 None
 1.50A 4cevA-4a14A:
1.7
4cevC-4a14A:
1.7		 4cevA-4a14A:
23.92
4cevC-4a14A:
23.92
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.
4hg2 METHYLTRANSFERASE
TYPE 11

(Anaeromyxobacter
dehalogenans) 		PF08241
(Methyltransf_11) 		4 ASP A 215
ARG A 209
HIS A 208
LEU A 149
 None
 1.50A 4cevA-4hg2A:
3.3
4cevC-4hg2A:
3.4		 4cevA-4hg2A:
20.86
4cevC-4hg2A:
20.86
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.
4j72 PHOSPHO-N-ACETYLMURA
MOYL-PENTAPEPTIDE-TR
ANSFERASE

(Aquifex
aeolicus) 		PF00953
(Glycos_transf_4)
PF10555
(MraY_sig1) 		4 ASP A 196
ARG A 320
HIS A 325
LEU A 332
 None
None
NI  A 401 (-3.2A)
None
 1.33A 4cevA-4j72A:
undetectable
4cevC-4j72A:
undetectable		 4cevA-4j72A:
22.28
4cevC-4j72A:
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.
4jkx BETA-GALACTOSIDE-SPE
CIFIC LECTIN 1 A
CHAIN

(Viscum album) 		PF00161
(RIP) 		4 MET A 192
ASP A 189
ARG A 175
LEU A 195
 None
 1.03A 4cevA-4jkxA:
undetectable
4cevC-4jkxA:
undetectable		 4cevA-4jkxA:
27.18
4cevC-4jkxA:
27.18
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.
4oua LATENT FORM OF PPO4
TYROSINASE

(Agaricus
bisporus) 		PF00264
(Tyrosinase) 		4 ASP B 287
ARG B  92
HIS B  91
LEU B 247
 None
None
CU1  B 601 (-3.2A)
None
 1.11A 4cevA-4ouaB:
undetectable
4cevC-4ouaB:
undetectable		 4cevA-4ouaB:
18.89
4cevC-4ouaB:
18.89
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.
4oua PROTEOLYTICALLY
ACTIVATED FORM OF
PPO4 TYROSINASE

(Agaricus
bisporus) 		PF00264
(Tyrosinase) 		4 ASP A 287
ARG A  92
HIS A  91
LEU A 247
 None
None
CU1  A 401 (-3.3A)
None
 1.14A 4cevA-4ouaA:
undetectable
4cevC-4ouaA:
undetectable		 4cevA-4ouaA:
21.31
4cevC-4ouaA:
21.31
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.
4ow4 BETA-TERFOIL
DESIGNED BY FOLDING
NUCLEUS SYMMETRIC
EXPANSION
('PHIFOIL')

(synthetic
construct) 		PF00167
(FGF) 		4 ASP A 127
ARG A 110
GLU A  18
LEU A 132
 None
 1.20A 4cevA-4ow4A:
undetectable
4cevC-4ow4A:
undetectable		 4cevA-4ow4A:
16.38
4cevC-4ow4A:
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.
4pxq D-GLUCURONYL C5
EPIMERASE B

(Danio rerio) 		PF06662
(C5-epim_C) 		4 ASP A 529
ARG A 531
HIS A 532
LEU A 541
 None
SGN  A 804 (-3.1A)
None
None
 1.38A 4cevA-4pxqA:
undetectable
4cevC-4pxqA:
undetectable		 4cevA-4pxqA:
18.89
4cevC-4pxqA:
18.89
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.
4rmf ASPARTATE--TRNA(ASP/
ASN) LIGASE

(Mycolicibacterium
smegmatis) 		PF00152
(tRNA-synt_2)
PF01336
(tRNA_anti-codon)
PF02938
(GAD) 		4 ASP A 494
ARG A 492
GLU A 497
LEU A 518
 None
 1.46A 4cevA-4rmfA:
undetectable
4cevC-4rmfA:
undetectable		 4cevA-4rmfA:
21.02
4cevC-4rmfA:
21.02
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.
4s1p UNCHARACTERIZED
PROTEIN

(Slackia
heliotrinireducens) 		PF13472
(Lipase_GDSL_2) 		4 MET A 118
ASP A 122
ARG A 126
LEU A 113
 None
 1.29A 4cevA-4s1pA:
3.0
4cevC-4s1pA:
2.9		 4cevA-4s1pA:
20.93
4cevC-4s1pA:
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.
4udj UHGB_MP

(uncultured
organism) 		PF04041
(Glyco_hydro_130) 		4 MET A  67
ASP A  61
ARG A  59
HIS A  70
 None
None
BMA  A 329 (-4.0A)
None
 1.49A 4cevA-4udjA:
undetectable
4cevC-4udjA:
undetectable		 4cevA-4udjA:
22.28
4cevC-4udjA:
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.
4wrn MALTOSE-BINDING
PERIPLASMIC
PROTEIN,UROMODULIN

(Escherichia
coli;
Homo sapiens) 		PF00100
(Zona_pellucida)
PF13416
(SBP_bac_8) 		4 MET A 590
ASP A 592
ARG A 559
LEU A 601
 None
 1.07A 4cevA-4wrnA:
undetectable
4cevC-4wrnA:
undetectable		 4cevA-4wrnA:
18.52
4cevC-4wrnA:
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.
4zxl O-GLCNACASE NAGJ

(Clostridium
perfringens) 		PF02838
(Glyco_hydro_20b)
PF07555
(NAGidase) 		4 MET A 505
ASP A 506
ARG A 502
LEU A 525
 None
 1.44A 4cevA-4zxlA:
2.2
4cevC-4zxlA:
2.3		 4cevA-4zxlA:
19.57
4cevC-4zxlA:
19.57
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.
4zxs VIRION EGRESS
PROTEIN UL31

(Human
alphaherpesvirus
1) 		PF02718
(Herpes_UL31) 		4 MET B 214
ASP B 207
ARG B 257
LEU B 185
 None
 1.42A 4cevA-4zxsB:
undetectable
4cevC-4zxsB:
undetectable		 4cevA-4zxsB:
22.39
4cevC-4zxsB:
22.39
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.
5a0z CHOLINE
TRIMETHYLAMINE LYASE

(Klebsiella
pneumoniae) 		PF01228
(Gly_radical)
PF02901
(PFL-like) 		4 ASP A 399
HIS A 350
GLU A 401
LEU A 396
 None
 1.46A 4cevA-5a0zA:
undetectable
4cevC-5a0zA:
undetectable		 4cevA-5a0zA:
17.29
4cevC-5a0zA:
17.29
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.
5aor DOSAGE COMPENSATION
REGULATOR

(Drosophila
melanogaster) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF04408
(HA2)
PF07717
(OB_NTP_bind) 		4 MET A 843
ARG A 867
GLU A1116
LEU A 855
 None
 1.22A 4cevA-5aorA:
3.2
4cevC-5aorA:
undetectable		 4cevA-5aorA:
11.87
4cevC-5aorA:
11.87
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.
5bsz N-METHYLTRANSFERASE

(Streptoalloteichus
sp. ATCC 53650) 		PF13649
(Methyltransf_25) 		4 ASP A 205
ARG A 184
HIS A 185
LEU A 208
 EDO  A 302 (-3.4A)
EDO  A 302 ( 4.4A)
THM  A 306 (-4.4A)
None
 1.05A 4cevA-5bszA:
4.3
4cevC-5bszA:
4.3		 4cevA-5bszA:
25.87
4cevC-5bszA:
25.87
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.
5c33 RYANODINE RECEPTOR 2

(Mus musculus) 		PF00622
(SPRY) 		4 MET A 678
ASP A 680
ARG A 801
LEU A 677
 None
 1.25A 4cevA-5c33A:
undetectable
4cevC-5c33A:
undetectable		 4cevA-5c33A:
21.25
4cevC-5c33A:
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.
5cju ISOBUTYRYL-COA
MUTASE FUSED

(Cupriavidus
metallidurans) 		PF01642
(MM_CoA_mutase)
PF02310
(B12-binding)
PF03308
(ArgK) 		4 ASP A 561
ARG A 472
GLU A 562
LEU A 513
 None
 1.44A 4cevA-5cjuA:
1.0
4cevC-5cjuA:
undetectable		 4cevA-5cjuA:
14.61
4cevC-5cjuA:
14.61
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.
5dkx ALPHA
GLUCOSIDASE-LIKE
PROTEIN

(Chaetomium
thermophilum) 		PF01055
(Glyco_hydro_31)
PF13802
(Gal_mutarotas_2)
PF17137
(DUF5110) 		4 ASP A 892
ARG A 879
HIS A 878
GLU A 894
 None
 1.44A 4cevA-5dkxA:
undetectable
4cevC-5dkxA:
undetectable		 4cevA-5dkxA:
14.39
4cevC-5dkxA:
14.39
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.
5ikm NS5 METHYL
TRANSFERASE

(Dengue virus) 		PF01728
(FtsJ) 		4 ASP A 254
ARG A  38
GLU A 252
LEU A 209
 None
SO4  A 303 (-4.0A)
None
None
 1.32A 4cevA-5ikmA:
undetectable
4cevC-5ikmA:
undetectable		 4cevA-5ikmA:
21.86
4cevC-5ikmA:
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.
5loa MESO-DIAMINOPIMELATE
D-DEHYDROGENASE

(Corynebacterium
glutamicum) 		PF16654
(DAPDH_C) 		4 MET A  28
ASP A  27
ARG A 283
HIS A 286
 None
 1.30A 4cevA-5loaA:
undetectable
4cevC-5loaA:
undetectable		 4cevA-5loaA:
21.78
4cevC-5loaA:
21.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5m5p PRE-MRNA-SPLICING
HELICASE BRR2

(Saccharomyces
cerevisiae) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF02889
(Sec63) 		4 MET A1609
ASP A1608
HIS A1635
LEU A1610
 None
 1.27A 4cevA-5m5pA:
3.3
4cevC-5m5pA:
2.1		 4cevA-5m5pA:
10.25
4cevC-5m5pA:
10.25
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.
5nag KYNURENINE
3-MONOOXYGENASE

(Pseudomonas
fluorescens) 		PF01494
(FAD_binding_3) 		4 ASP A 120
ARG A  43
GLU A  73
LEU A  70
 None
 1.35A 4cevA-5nagA:
undetectable
4cevC-5nagA:
undetectable		 4cevA-5nagA:
22.51
4cevC-5nagA:
22.51
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.
5u09 CANNABINOID RECEPTOR
1,GLGA GLYCOGEN
SYNTHASE

(Homo sapiens;
Pyrococcus
abyssi) 		PF00001
(7tm_1)
PF00534
(Glycos_transf_1) 		4 MET A 363
ASP A 366
GLU A 273
LEU A 276
 None
 1.49A 4cevA-5u09A:
2.4
4cevC-5u09A:
2.5		 4cevA-5u09A:
20.40
4cevC-5u09A:
20.40
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.
5u2o J30 CCH

(Thermobacillus
composti) 		no annotation 4 ASP A 103
ARG A 110
HIS A 111
LEU A  95
 None
 1.43A 4cevA-5u2oA:
undetectable
4cevC-5u2oA:
undetectable		 4cevA-5u2oA:
undetectable
4cevC-5u2oA:
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.
5uc2 DOMAIN OF UNKNOWN
FUNCTION DUF1849

(Brucella
abortus) 		PF08904
(DUF1849) 		4 ASP A 267
ARG A  37
HIS A  36
LEU A 263
 None
None
EDO  A 303 (-4.7A)
None
 1.10A 4cevA-5uc2A:
undetectable
4cevC-5uc2A:
undetectable		 4cevA-5uc2A:
21.81
4cevC-5uc2A:
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.
5w1u CARBOXYLIC ESTER
HYDROLASE

(Culex
quinquefasciatus) 		PF00135
(COesterase) 		4 ASP A 421
ARG A 438
GLU A 323
LEU A 326
 None
 0.98A 4cevA-5w1uA:
undetectable
4cevC-5w1uA:
undetectable		 4cevA-5w1uA:
21.39
4cevC-5w1uA:
21.39
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.
5wu6 SPECKLE TARGETED
PIP5K1A-REGULATED
POLY(A) POLYMERASE

(Homo sapiens) 		PF00076
(RRM_1)
PF03828
(PAP_assoc) 		4 ASP A 478
ARG A 481
GLU A 401
LEU A 398
 None
 1.28A 4cevA-5wu6A:
undetectable
4cevC-5wu6A:
undetectable		 4cevA-5wu6A:
20.66
4cevC-5wu6A:
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.
6cmz DIHYDROLIPOYL
DEHYDROGENASE

(Burkholderia
cenocepacia) 		no annotation 4 ASP A 401
ARG A 399
HIS A 403
LEU A 372
 None
 1.41A 4cevA-6cmzA:
undetectable
4cevC-6cmzA:
undetectable		 4cevA-6cmzA:
undetectable
4cevC-6cmzA:
undetectable