SIMILAR PATTERNS OF AMINO ACIDS FOR 4ACB_C_DXCC1478_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.
1f8w NADH PEROXIDASE

(Enterococcus
faecalis)
PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2)
4 SER A 326
THR A 398
ILE A 401
THR A 300
None
None
None
FAD  A 448 (-3.8A)
1.07A 4acbC-1f8wA:
2.2
4acbC-1f8wA:
23.17
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.
1gwc GLUTATHIONE
S-TRANSFERASE TSI-1


(Aegilops
tauschii)
PF00043
(GST_C)
PF02798
(GST_N)
4 ASP A 185
THR A 175
THR A 189
PHE A 184
None
0.99A 4acbC-1gwcA:
undetectable
4acbC-1gwcA:
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.
1h17 FORMATE
ACETYLTRANSFERASE 1


(Escherichia
coli)
PF01228
(Gly_radical)
PF02901
(PFL-like)
4 ASP A 306
ILE A 255
THR A 359
PHE A 356
None
0.84A 4acbC-1h17A:
undetectable
4acbC-1h17A:
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.
1jqk CARBON MONOXIDE
DEHYDROGENASE


(Rhodospirillum
rubrum)
PF03063
(Prismane)
4 SER A 234
ASP A 235
ILE A 102
PHE A 238
None
0.99A 4acbC-1jqkA:
undetectable
4acbC-1jqkA:
22.58
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.
1k32 TRICORN PROTEASE

(Thermoplasma
acidophilum)
PF03572
(Peptidase_S41)
PF07676
(PD40)
PF14684
(Tricorn_C1)
PF14685
(Tricorn_PDZ)
4 SER A 234
THR A 246
ILE A 245
THR A 181
None
0.95A 4acbC-1k32A:
3.0
4acbC-1k32A:
19.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1l9x GAMMA-GLUTAMYL
HYDROLASE


(Homo sapiens)
PF07722
(Peptidase_C26)
4 SER A 176
THR A 197
ILE A 201
THR A 181
None
0.94A 4acbC-1l9xA:
2.9
4acbC-1l9xA:
21.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1lk5 D-RIBOSE-5-PHOSPHATE
ISOMERASE


(Pyrococcus
horikoshii)
PF06026
(Rib_5-P_isom_A)
4 ASP A  85
THR A 116
THR A  32
PHE A  35
None
1.09A 4acbC-1lk5A:
undetectable
4acbC-1lk5A:
20.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1p22 F-BOX/WD-REPEAT
PROTEIN 1A


(Homo sapiens)
PF00400
(WD40)
PF12937
(F-box-like)
4 SER A 282
THR A 540
ILE A 541
THR A 288
None
1.09A 4acbC-1p22A:
undetectable
4acbC-1p22A:
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.
1qhm PYRUVATE
FORMATE-LYASE


(Escherichia
coli)
PF02901
(PFL-like)
4 ASP A1306
ILE A1255
THR A1359
PHE A1356
None
0.84A 4acbC-1qhmA:
2.4
4acbC-1qhmA:
22.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1r8i TRAC

(Escherichia
coli)
PF07996
(T4SS)
4 SER A 175
ASP A 178
THR A 164
ILE A 167
None
0.97A 4acbC-1r8iA:
undetectable
4acbC-1r8iA:
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.
1rpx PROTEIN
(RIBULOSE-PHOSPHATE
3-EPIMERASE)


(Solanum
tuberosum)
PF00834
(Ribul_P_3_epim)
4 SER A  62
ASP A  61
THR A  67
ILE A  66
None
0.96A 4acbC-1rpxA:
2.5
4acbC-1rpxA:
19.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1u7p MAGNESIUM-DEPENDENT
PHOSPHATASE-1


(Mus musculus)
PF12689
(Acid_PPase)
4 ASP A 122
THR A 137
THR A  15
PHE A  10
MG  A 501 ( 4.4A)
None
None
None
1.01A 4acbC-1u7pA:
2.8
4acbC-1u7pA:
16.49
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.
1vbl PECTATE LYASE 47

(Bacillus sp.
TS-47)
PF00544
(Pec_lyase_C)
4 ASP A 360
THR A 357
ILE A 368
PHE A 332
None
1.06A 4acbC-1vblA:
undetectable
4acbC-1vblA:
22.33
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.
2gp4 6-PHOSPHOGLUCONATE
DEHYDRATASE


(Shewanella
oneidensis)
PF00920
(ILVD_EDD)
4 ASP A 321
THR A   9
ILE A  12
PHE A 323
None
0.91A 4acbC-2gp4A:
2.6
4acbC-2gp4A:
22.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2hxv DIAMINOHYDROXYPHOSPH
ORIBOSYLAMINOPYRIMID
INE DEAMINASE/
5-AMINO-6-(5-PHOSPHO
RIBOSYLAMINO)URACIL
REDUCTASE


(Thermotoga
maritima)
PF00383
(dCMP_cyt_deam_1)
PF01872
(RibD_C)
4 SER A 169
THR A 173
ILE A 172
THR A 196
NDP  A 400 ( 2.6A)
GOL  A 503 (-4.2A)
GOL  A 503 (-4.0A)
NDP  A 400 (-3.2A)
0.79A 4acbC-2hxvA:
undetectable
4acbC-2hxvA:
24.32
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.
2i71 HYPOTHETICAL PROTEIN

(Sulfolobus
solfataricus)
PF09455
(Cas_DxTHG)
4 SER A 272
THR A 194
ILE A 197
PHE A 276
None
0.92A 4acbC-2i71A:
undetectable
4acbC-2i71A:
25.29
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.
2iip NICOTINAMIDE
N-METHYLTRANSFERASE


(Homo sapiens)
PF01234
(NNMT_PNMT_TEMT)
4 SER A 162
ASP A  61
ILE A 195
THR A  84
None
0.89A 4acbC-2iipA:
2.1
4acbC-2iipA:
22.52
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.
2lbp LEUCINE-BINDING
PROTEIN


(Escherichia
coli)
PF13458
(Peripla_BP_6)
4 SER A 122
ASP A 121
THR A 127
THR A 102
None
1.08A 4acbC-2lbpA:
2.0
4acbC-2lbpA:
21.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2oaj PROTEIN SNI1

(Saccharomyces
cerevisiae)
PF08596
(Lgl_C)
4 SER A 294
THR A 314
ILE A 316
THR A 288
None
1.03A 4acbC-2oajA:
undetectable
4acbC-2oajA:
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.
2p11 HYPOTHETICAL PROTEIN

(Paraburkholderia
xenovorans)
no annotation 4 ASP A 167
THR A 185
THR A  20
PHE A  15
None
0.95A 4acbC-2p11A:
3.3
4acbC-2p11A:
20.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qwu INTRACELLULAR GROWTH
LOCUS, SUBUNIT C


(Francisella
tularensis)
PF11550
(IglC)
4 SER A  88
ASP A 181
THR A 184
ILE A  87
None
0.98A 4acbC-2qwuA:
undetectable
4acbC-2qwuA:
18.83
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.
2qzw CANDIDAPEPSIN-1

(Candida
albicans)
PF00026
(Asp)
4 THR A 197
ILE A 196
THR A 224
PHE A 310
None
1.05A 4acbC-2qzwA:
undetectable
4acbC-2qzwA:
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.
2wm8 MAGNESIUM-DEPENDENT
PHOSPHATASE 1


(Homo sapiens)
PF12689
(Acid_PPase)
4 ASP A 123
THR A 138
THR A  16
PHE A  11
None
0.94A 4acbC-2wm8A:
2.5
4acbC-2wm8A:
17.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2xnh DNA TOPOISOMERASE
2-BINDING PROTEIN 1


(Homo sapiens)
PF00533
(BRCT)
PF12738
(PTCB-BRCT)
4 SER A 270
ASP A 269
ILE A 199
PHE A 267
None
1.04A 4acbC-2xnhA:
3.1
4acbC-2xnhA:
19.10
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.
2xt6 2-OXOGLUTARATE
DECARBOXYLASE


(Mycolicibacterium
smegmatis)
PF00198
(2-oxoacid_dh)
PF00676
(E1_dh)
PF02779
(Transket_pyr)
PF16870
(OxoGdeHyase_C)
4 ASP A 324
ILE A 317
THR A 328
PHE A 325
None
1.06A 4acbC-2xt6A:
4.1
4acbC-2xt6A:
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.
2xt6 2-OXOGLUTARATE
DECARBOXYLASE


(Mycolicibacterium
smegmatis)
PF00198
(2-oxoacid_dh)
PF00676
(E1_dh)
PF02779
(Transket_pyr)
PF16870
(OxoGdeHyase_C)
4 THR A1038
ILE A1039
THR A1183
PHE A1180
None
1.04A 4acbC-2xt6A:
4.1
4acbC-2xt6A:
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.
2yia RNA-DIRECTED RNA
POLYMERASE


(Infectious
pancreatic
necrosis virus)
PF04197
(Birna_RdRp)
4 ASP A 388
THR A 485
ILE A 385
PHE A 477
None
1.02A 4acbC-2yiaA:
undetectable
4acbC-2yiaA:
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.
2yib RNA-DIRECTED RNA
POLYMERASE


(Infectious
pancreatic
necrosis virus)
PF04197
(Birna_RdRp)
4 ASP D 388
THR D 485
ILE D 385
PHE D 477
None
1.03A 4acbC-2yibD:
undetectable
4acbC-2yibD:
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.
3a9s D-ARABINOSE
ISOMERASE


(Aeribacillus
pallidus)
PF02952
(Fucose_iso_C)
PF07881
(Fucose_iso_N1)
PF07882
(Fucose_iso_N2)
4 ASP A 453
ILE A 396
THR A 435
PHE A 454
MN  A 801 (-2.6A)
None
None
None
1.08A 4acbC-3a9sA:
8.5
4acbC-3a9sA:
22.48
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.
3b70 ENOYL REDUCTASE

(Aspergillus
terreus)
PF00107
(ADH_zinc_N)
PF08240
(ADH_N)
4 SER A 138
THR A 284
ILE A 285
THR A 177
None
None
None
NAP  A 372 (-3.5A)
1.01A 4acbC-3b70A:
3.2
4acbC-3b70A:
19.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3bij UNCHARACTERIZED
PROTEIN GSU0716


(Geobacter
sulfurreducens)
PF00656
(Peptidase_C14)
4 ASP A  90
THR A 102
ILE A 111
THR A  91
None
1.08A 4acbC-3bijA:
undetectable
4acbC-3bijA:
19.75
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.
3bji PROTO-ONCOGENE VAV

(Homo sapiens)
PF00130
(C1_1)
PF00169
(PH)
PF00621
(RhoGEF)
4 ASP A 376
THR A 384
ILE A 383
THR A 539
None
1.07A 4acbC-3bjiA:
undetectable
4acbC-3bjiA:
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.
3ce2 PUTATIVE PEPTIDASE

(Chlamydia
abortus)
PF01432
(Peptidase_M3)
PF08439
(Peptidase_M3_N)
4 SER A 475
THR A 280
ILE A 283
THR A 498
None
1.05A 4acbC-3ce2A:
undetectable
4acbC-3ce2A:
23.83
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.
3cyq CHEMOTAXIS PROTEIN
MOTB


(Helicobacter
pylori)
no annotation 4 ASP B 237
ILE B 244
THR B 233
PHE B 231
None
1.09A 4acbC-3cyqB:
undetectable
4acbC-3cyqB:
14.38
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.
3d8m BASEPLATE PROTEIN,
RECEPTOR BINDING
PROTEIN


(Lactococcus
phage TP901-1;
Lactococcus
virus P2)
PF08931
(Caudo_bapla_RBP)
4 THR A 143
ILE A 142
THR A 156
PHE A  91
None
0.96A 4acbC-3d8mA:
undetectable
4acbC-3d8mA:
16.63
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.
3da0 CLEAVED CHIMERIC
RECEPTOR BINDING
PROTEIN FROM
BACTERIOPHAGES
TP901-1 AND P2


(Lactococcus
phage TP901-1;
Lactococcus
virus P2)
PF08931
(Caudo_bapla_RBP)
4 THR A 143
ILE A 142
THR A 156
PHE A  91
None
1.06A 4acbC-3da0A:
2.2
4acbC-3da0A:
14.04
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.
3dlc PUTATIVE
S-ADENOSYL-L-METHION
INE-DEPENDENT
METHYLTRANSFERASE


(Methanococcus
maripaludis)
PF08241
(Methyltransf_11)
4 SER A 116
ASP A  48
THR A 143
ILE A 145
None
SAM  A 220 ( 4.9A)
None
None
0.94A 4acbC-3dlcA:
undetectable
4acbC-3dlcA:
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.
3fge PUTATIVE FLAVIN
REDUCTASE WITH SPLIT
BARREL DOMAIN


(Shewanella
frigidimarina)
PF01613
(Flavin_Reduct)
4 SER A 107
THR A  72
THR A 112
PHE A 109
None
1.00A 4acbC-3fgeA:
undetectable
4acbC-3fgeA:
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.
3gaz ALCOHOL
DEHYDROGENASE
SUPERFAMILY PROTEIN


(Novosphingobium
aromaticivorans)
PF00107
(ADH_zinc_N)
PF08240
(ADH_N)
4 ASP A  70
THR A 334
ILE A 333
THR A  95
None
1.06A 4acbC-3gazA:
2.6
4acbC-3gazA:
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.
3io0 ETUB PROTEIN

(Clostridium
kluyveri)
PF00936
(BMC)
4 SER A 268
THR A 248
ILE A 247
THR A 201
None
1.00A 4acbC-3io0A:
undetectable
4acbC-3io0A:
20.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ky9 PROTO-ONCOGENE VAV

(Homo sapiens)
PF00130
(C1_1)
PF00169
(PH)
PF00621
(RhoGEF)
PF11971
(CAMSAP_CH)
4 ASP A 376
THR A 384
ILE A 383
THR A 539
None
1.07A 4acbC-3ky9A:
undetectable
4acbC-3ky9A:
20.96
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.
3lnp AMIDOHYDROLASE
FAMILY PROTEIN
OLEI01672_1_465


(Oleispira
antarctica)
PF01979
(Amidohydro_1)
4 SER A 252
THR A 257
THR A 247
PHE A 249
None
0.72A 4acbC-3lnpA:
2.3
4acbC-3lnpA:
21.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3lqy PUTATIVE
ISOCHORISMATASE
HYDROLASE


(Oleispira
antarctica)
PF00857
(Isochorismatase)
4 ASP A  13
THR A 122
ILE A 126
PHE A  14
None
1.02A 4acbC-3lqyA:
5.0
4acbC-3lqyA:
19.42
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.
3muq UNCHARACTERIZED
CONSERVED PROTEIN


(Vibrio
parahaemolyticus)
PF12849
(PBP_like_2)
4 THR A 190
ILE A 110
THR A 160
PHE A 156
None
1.05A 4acbC-3muqA:
undetectable
4acbC-3muqA:
19.92
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.
3na8 PUTATIVE
DIHYDRODIPICOLINATE
SYNTHETASE


(Pseudomonas
aeruginosa)
PF00701
(DHDPS)
4 ASP A  43
THR A  32
ILE A  33
PHE A  36
None
0.96A 4acbC-3na8A:
2.6
4acbC-3na8A:
23.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ncm PROTEIN (NEURAL CELL
ADHESION MOLECULE,
LARGE ISOFORM)


(Rattus
norvegicus)
PF13927
(Ig_3)
4 ASP A  24
THR A   9
ILE A  88
PHE A   4
None
1.08A 4acbC-3ncmA:
undetectable
4acbC-3ncmA:
13.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3qbw ANHYDRO-N-ACETYLMURA
MIC ACID KINASE


(Pseudomonas
aeruginosa)
PF03702
(AnmK)
4 SER A 167
ASP A 182
ILE A 273
THR A 236
None
SO4  A 372 ( 4.7A)
None
None
1.02A 4acbC-3qbwA:
undetectable
4acbC-3qbwA:
21.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3qlv GLUTAMATE RECEPTOR,
IONOTROPIC KAINATE 5


(Rattus
norvegicus)
PF01094
(ANF_receptor)
4 SER A 249
THR A 227
THR A 340
PHE A 251
None
1.10A 4acbC-3qlvA:
undetectable
4acbC-3qlvA:
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.
3zbi TRAF PROTEIN

(Escherichia
coli)
PF03743
(TrbI)
5 SER A 852
ASP A 856
ILE A 849
THR A 857
PHE A 854
None
1.44A 4acbC-3zbiA:
undetectable
4acbC-3zbiA:
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.
3zhr MULTIFUNCTIONAL
2-OXOGLUTARATE
METABOLISM ENZYME


(Mycolicibacterium
smegmatis)
PF00676
(E1_dh)
PF02779
(Transket_pyr)
PF16870
(OxoGdeHyase_C)
4 THR A1038
ILE A1039
THR A1183
PHE A1180
MPD  A2228 ( 3.9A)
None
None
None
1.04A 4acbC-3zhrA:
3.4
4acbC-3zhrA:
20.02
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.
3zok 3-DEHYDROQUINATE
SYNTHASE


(Actinidia
chinensis)
PF01761
(DHQ_synthase)
4 SER A  31
ASP A 180
THR A  14
THR A 183
None
None
None
NAD  A1381 (-4.9A)
1.04A 4acbC-3zokA:
5.3
4acbC-3zokA:
23.19
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4aca TRANSLATION
ELONGATION FACTOR
SELB


(Methanococcus
maripaludis)
PF00009
(GTP_EFTU)
PF03144
(GTP_EFTU_D2)
5 SER A 121
ASP A 122
ILE A 129
THR A 158
PHE A 160
None
0.55A 4acbC-4acaA:
51.7
4acbC-4acaA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4aca TRANSLATION
ELONGATION FACTOR
SELB


(Methanococcus
maripaludis)
PF00009
(GTP_EFTU)
PF03144
(GTP_EFTU_D2)
5 SER A 121
ASP A 122
THR A 126
ILE A 129
THR A 158
None
0.48A 4acbC-4acaA:
51.7
4acbC-4acaA:
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.
4aov ISOCITRATE
DEHYDROGENASE [NADP]


(Desulfotalea
psychrophila)
PF00180
(Iso_dh)
4 SER A 354
ASP A 353
THR A 359
PHE A 351
None
0.94A 4acbC-4aovA:
3.2
4acbC-4aovA:
22.15
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.
4aov ISOCITRATE
DEHYDROGENASE [NADP]


(Desulfotalea
psychrophila)
PF00180
(Iso_dh)
4 SER A 354
THR A 359
ILE A 358
PHE A 351
None
0.89A 4acbC-4aovA:
3.2
4acbC-4aovA:
22.15
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.
4c13 UDP-N-ACETYLMURAMOYL
-L-ALANYL-D-GLUTAMAT
E--L-LYSINE LIGASE


(Staphylococcus
aureus)
PF01225
(Mur_ligase)
PF02875
(Mur_ligase_C)
PF08245
(Mur_ligase_M)
4 ASP A 282
ILE A 302
THR A 289
PHE A 283
None
1.01A 4acbC-4c13A:
4.3
4acbC-4c13A:
23.06
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.
4crs SERINE/THREONINE-PRO
TEIN KINASE N2


(Homo sapiens)
PF00069
(Pkinase)
PF00433
(Pkinase_C)
4 THR A 936
ILE A 937
THR A 951
PHE A 946
None
None
None
AGS  A1985 (-4.8A)
0.96A 4acbC-4crsA:
undetectable
4acbC-4crsA:
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.
4dk0 PUTATIVE MACA

(Aggregatibacter
actinomycetemcomitans)
PF16576
(HlyD_D23)
4 SER A  90
ASP A  89
ILE A  94
THR A  69
None
1.00A 4acbC-4dk0A:
3.5
4acbC-4dk0A:
22.87
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.
4dna PROBABLE GLUTATHIONE
REDUCTASE


(Sinorhizobium
meliloti)
PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2)
4 THR A 159
ILE A 158
THR A 196
PHE A 189
None
1.01A 4acbC-4dnaA:
2.4
4acbC-4dnaA:
24.64
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.
4exb PUTATIVE
UNCHARACTERIZED
PROTEIN


(Pseudomonas
aeruginosa)
PF00248
(Aldo_ket_red)
4 SER A  93
ASP A  66
ILE A 129
THR A  27
None
0.78A 4acbC-4exbA:
3.6
4acbC-4exbA:
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.
4gb7 6-AMINOHEXANOATE-DIM
ER HYDROLASE


(Bacillus
anthracis)
PF00144
(Beta-lactamase)
4 ASP A 163
THR A 260
ILE A 257
THR A 172
None
1.06A 4acbC-4gb7A:
undetectable
4acbC-4gb7A:
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.
4gqo LMO0859 PROTEIN

(Listeria
monocytogenes)
PF13416
(SBP_bac_8)
4 ASP A 273
THR A 298
ILE A 297
PHE A 264
None
0.80A 4acbC-4gqoA:
undetectable
4acbC-4gqoA:
24.42
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.
4irf MALARIAL CLPB2
ATPASE/HSP101
PROTEIN


(Plasmodium
falciparum)
PF02861
(Clp_N)
5 SER A  47
ASP A  48
THR A  16
ILE A  19
THR A  52
None
1.30A 4acbC-4irfA:
undetectable
4acbC-4irfA:
17.07
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.
4j4b PYLD

(Methanosarcina
barkeri)
no annotation 4 SER A  66
THR A  71
ILE A  70
PHE A  63
None
None
None
0TF  A 904 (-3.8A)
1.05A 4acbC-4j4bA:
undetectable
4acbC-4j4bA:
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.
4k3y NEURAMINIDASE

(Influenza A
virus)
PF00064
(Neur)
4 SER A 407
ILE A 424
THR A 279
PHE A 352
None
1.02A 4acbC-4k3yA:
undetectable
4acbC-4k3yA:
21.69
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.
4mrd CD44 ANTIGEN

(Mus musculus)
PF00193
(Xlink)
4 ASP A 139
THR A 151
ILE A 150
PHE A  60
None
1.07A 4acbC-4mrdA:
undetectable
4acbC-4mrdA:
13.92
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.
4nh0 CELL
DIVISIONFTSK/SPOIIIE


(Thermomonospora
curvata)
PF01580
(FtsK_SpoIIIE)
4 SER A 626
ASP A 592
ILE A 478
PHE A 594
None
1.01A 4acbC-4nh0A:
undetectable
4acbC-4nh0A:
18.27
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.
4p56 PUTATIVE
EXTRACELLULAR
SOLUTE-BINDING
PROTEIN


(Bordetella
bronchiseptica)
PF03480
(DctP)
4 THR A  88
ILE A 241
THR A 102
PHE A  99
None
None
None
PGE  A 402 ( 4.5A)
0.89A 4acbC-4p56A:
undetectable
4acbC-4p56A:
24.74
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.
4qs9 HEXOKINASE-1

(Arabidopsis
thaliana)
PF00349
(Hexokinase_1)
PF03727
(Hexokinase_2)
4 SER A 140
ASP A 141
ILE A 199
PHE A 144
None
1.07A 4acbC-4qs9A:
undetectable
4acbC-4qs9A:
24.40
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.
4qs9 HEXOKINASE-1

(Arabidopsis
thaliana)
PF00349
(Hexokinase_1)
PF03727
(Hexokinase_2)
4 SER A 140
ASP A 141
THR A 137
ILE A 199
None
1.08A 4acbC-4qs9A:
undetectable
4acbC-4qs9A:
24.40
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.
4u39 CELL DIVISION
PROTEIN FTSZ


(Bacillus
subtilis)
PF00091
(Tubulin)
PF12327
(FtsZ_C)
4 THR A 309
ILE A 311
THR A 102
PHE A 100
None
1.02A 4acbC-4u39A:
5.0
4acbC-4u39A:
21.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4uou FUCOSE-SPECIFIC
LECTIN FLEA


(Aspergillus
fumigatus)
PF07938
(Fungal_lectin)
4 THR A 204
ILE A 205
THR A 213
PHE A 233
None
0.96A 4acbC-4uouA:
undetectable
4acbC-4uouA:
21.13
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.
4v1r ALPHA-1,6-MANNANASE

(Bacteroides
thetaiotaomicron)
PF03663
(Glyco_hydro_76)
4 SER A 103
ASP A 104
THR A  92
ILE A  95
None
0.92A 4acbC-4v1rA:
undetectable
4acbC-4v1rA:
21.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4w5z CHITINASE 60

(Moritella
marina)
PF00704
(Glyco_hydro_18)
4 ASP A 213
THR A  26
ILE A  25
THR A 187
None
1.05A 4acbC-4w5zA:
2.6
4acbC-4w5zA:
22.06
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.
4xb6 ALPHA-D-RIBOSE
1-METHYLPHOSPHONATE
5-PHOSPHATE C-P
LYASE


(Escherichia
coli)
PF06007
(PhnJ)
4 SER D 186
ASP D 184
ILE D 188
PHE D 205
None
0.99A 4acbC-4xb6D:
undetectable
4acbC-4xb6D:
19.11
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.
4xgc ORIGIN RECOGNITION
COMPLEX SUBUNIT 4


(Drosophila
melanogaster)
PF13191
(AAA_16)
PF14629
(ORC4_C)
4 ASP D  96
THR D 104
ILE D 103
THR D 159
None
1.04A 4acbC-4xgcD:
undetectable
4acbC-4xgcD:
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.
4xj5 CYCLIC AMP-GMP
SYNTHASE


(Vibrio cholerae)
no annotation 4 SER A 271
ASP A 270
ILE A 275
PHE A 268
None
0.99A 4acbC-4xj5A:
undetectable
4acbC-4xj5A:
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.
4yn1 FUSOLIN

(Anomala cuprea
entomopoxvirus)
PF03067
(LPMO_10)
4 THR A 131
ILE A 132
THR A 207
PHE A 209
None
EDO  A 406 ( 3.6A)
None
None
1.00A 4acbC-4yn1A:
undetectable
4acbC-4yn1A:
20.13
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.
5a2a APO FORM OF
ANOXYBACILLUS
ALPHA-AMYLASES


(Anoxybacillus
ayderensis)
PF00128
(Alpha-amylase)
4 ASP A 213
THR A 141
ILE A 102
PHE A 136
ACT  A1479 (-2.6A)
None
None
None
1.06A 4acbC-5a2aA:
2.8
4acbC-5a2aA:
22.07
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.
5czl GLUCANASE

(Raoultella
ornithinolytica)
PF01270
(Glyco_hydro_8)
4 SER A 120
ASP A 121
THR A 173
PHE A 169
None
0.88A 4acbC-5czlA:
undetectable
4acbC-5czlA:
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.
5d79 BERBERINE BRIDGE
ENZYME-LIKE PROTEIN


(Arabidopsis
thaliana)
PF01565
(FAD_binding_4)
PF08031
(BBE)
4 SER A 339
THR A 254
ILE A 253
PHE A 343
None
1.07A 4acbC-5d79A:
undetectable
4acbC-5d79A:
21.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5fif CARBOXYLASE

(Deinococcus
radiodurans)
PF01039
(Carboxyl_trans)
4 SER A 378
THR A 330
ILE A 343
THR A 419
None
1.06A 4acbC-5fifA:
2.2
4acbC-5fifA:
22.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5fxv HISTONE DEMETHYLASE
UTY


(Homo sapiens)
PF02373
(JmjC)
4 SER A1088
THR A1028
ILE A1029
THR A1033
None
1.07A 4acbC-5fxvA:
undetectable
4acbC-5fxvA:
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.
5gy3 GLUCANASE

(Klebsiella
pneumoniae)
PF01270
(Glyco_hydro_8)
4 SER A 135
ASP A 136
THR A 188
PHE A 184
None
0.95A 4acbC-5gy3A:
undetectable
4acbC-5gy3A:
20.04
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.
5kqc PEPTIDASE M23

(Staphylococcus
aureus)
PF01551
(Peptidase_M23)
4 SER A 146
ASP A 127
ILE A  89
THR A 149
None
1.01A 4acbC-5kqcA:
undetectable
4acbC-5kqcA:
16.42
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.
5o77 OMPK35

(Klebsiella
pneumoniae)
no annotation 4 SER A  31
ASP A  32
THR A  25
THR A  34
None
1.00A 4acbC-5o77A:
undetectable
4acbC-5o77A:
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.
5o9w THEBAINE
6-O-DEMETHYLASE


(Papaver
somniferum)
no annotation 4 ASP A 313
THR A 340
ILE A 320
PHE A 241
None
None
EDO  A 411 ( 4.3A)
None
1.10A 4acbC-5o9wA:
undetectable
4acbC-5o9wA:
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.
5ovo ADP-RIBOSYL-(DINITRO
GEN REDUCTASE)
HYDROLASE


(Azospirillum
brasilense)
no annotation 4 SER A 163
ASP A 164
ILE A 213
THR A 150
None
0.97A 4acbC-5ovoA:
undetectable
4acbC-5ovoA:
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.
5tz8 GLYCOSYL TRANSFERASE

(Staphylococcus
aureus)
PF00535
(Glycos_transf_2)
4 SER A  92
ASP A  93
THR A  17
ILE A  16
None
1.07A 4acbC-5tz8A:
undetectable
4acbC-5tz8A:
23.34
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.
5tz8 GLYCOSYL TRANSFERASE

(Staphylococcus
aureus)
PF00535
(Glycos_transf_2)
4 SER A  92
ASP A  94
THR A  17
ILE A  16
None
1.00A 4acbC-5tz8A:
undetectable
4acbC-5tz8A:
23.34
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.
5tzk GLYCOSYL TRANSFERASE

(Staphylococcus
aureus)
PF00535
(Glycos_transf_2)
4 SER C  92
ASP C  94
THR C  17
ILE C  16
UDP  C 401 (-2.8A)
MN  C 402 ( 4.0A)
None
None
0.98A 4acbC-5tzkC:
3.1
4acbC-5tzkC:
22.50
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.
5u3c CTP SYNTHASE

(Escherichia
coli)
PF00117
(GATase)
PF06418
(CTP_synth_N)
4 THR A 120
ILE A 123
THR A   9
PHE A   7
None
1.08A 4acbC-5u3cA:
7.7
4acbC-5u3cA:
22.03
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.
5uj7 ORIGIN RECOGNITION
COMPLEX SUBUNIT 4


(Homo sapiens)
PF13191
(AAA_16)
PF14629
(ORC4_C)
4 ASP C 107
THR C 115
ILE C 114
THR C 171
None
1.01A 4acbC-5uj7C:
undetectable
4acbC-5uj7C:
22.57
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.
5xqo PCRGLX PROTEIN

(Penicillium
chrysogenum)
no annotation 4 SER A 586
ASP A 584
THR A 633
ILE A 649
None
0.86A 4acbC-5xqoA:
undetectable
4acbC-5xqoA:
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.
5y09 PROTEASE DO-LIKE 9

(Arabidopsis
thaliana)
no annotation 4 SER A 508
ASP A 509
THR A 569
ILE A 572
None
1.06A 4acbC-5y09A:
2.9
4acbC-5y09A:
23.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ygk -

(-)
no annotation 4 THR A  51
ILE A  50
THR A 193
PHE A  36
DST  A 301 (-4.3A)
None
None
None
1.05A 4acbC-5ygkA:
2.3
4acbC-5ygkA:
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.
6b73 SOLUBLE CYTOCHROME
B562, KAPPA-TYPE
OPIOID RECEPTOR


(Escherichia
coli;
Homo sapiens)
no annotation 4 SER A 123
THR A 199
ILE A 208
THR A 117
None
1.01A 4acbC-6b73A:
undetectable
4acbC-6b73A:
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.
6dw1


(;
)
no annotation
no annotation
4 SER D 116
THR D  73
ILE D 147
THR E 131
None
1.01A 4acbC-6dw1D:
undetectable
4acbC-6dw1D:
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.
6epd PROTEASOME SUBUNIT
BETA TYPE-6


(Rattus
norvegicus)
no annotation 4 ASP 1 200
THR 1  35
ILE 1  36
THR 1 231
None
1.00A 4acbC-6epd1:
undetectable
4acbC-6epd1:
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.
6ftl RIBULOSE
BISPHOSPHATE
CARBOXYLASE LARGE
CHAIN


(Skeletonema
marinoi)
no annotation 4 ASP A 478
THR A 333
ILE A 345
PHE A 314
None
1.05A 4acbC-6ftlA:
2.4
4acbC-6ftlA:
undetectable