SIMILAR PATTERNS OF AMINO ACIDS FOR 3BJW_F_SVRF509_2

List of similar pattern of amino acids derived from ASSAM search

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

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


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


(Xanthobacter
autotrophicus)
PF00561
(Abhydrolase_1)
4 TYR A  63
PRO A 134
PHE A 243
TRP A 244
None
1.48A 3bjwD-1cijA:
undetectable
3bjwD-1cijA:
15.76
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.
1dtx ALPHA-DENDROTOXIN

(Dendroaspis
angusticeps)
PF00014
(Kunitz_BPTI)
4 LYS A   2
TYR A  25
ASN A  26
LYS A  30
PCA  A   1 ( 2.9A)
None
None
None
1.42A 3bjwD-1dtxA:
undetectable
3bjwD-1dtxA:
17.09
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1gmz PHOSPHOLIPASE A2

(Bothrops
pirajai)
PF00068
(Phospholip_A2_1)
4 LYS A  15
TYR A 103
ASN A 104
LYS A 105
None
0.96A 3bjwD-1gmzA:
19.7
3bjwD-1gmzA:
57.38
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1god PROTEIN
(PHOSPHOLIPASE A2)


(Cerrophidion
godmani)
PF00068
(Phospholip_A2_1)
4 LYS A  16
TYR A 113
ASN A 114
PRO A 121
None
0.99A 3bjwD-1godA:
19.8
3bjwD-1godA:
56.56
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.
1hle HORSE LEUKOCYTE
ELASTASE INHIBITOR


(Equus caballus)
PF00079
(Serpin)
4 TYR A 222
LYS A 224
LYS A 225
PRO A 228
None
1.29A 3bjwD-1hleA:
undetectable
3bjwD-1hleA:
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.
1j5s URONATE ISOMERASE

(Thermotoga
maritima)
PF02614
(UxaC)
4 TYR A 268
PRO A 154
PHE A 222
TRP A 177
None
1.42A 3bjwD-1j5sA:
undetectable
3bjwD-1j5sA:
11.82
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.
1np7 DNA PHOTOLYASE

(Synechocystis
sp. PCC 6803)
PF00875
(DNA_photolyase)
PF03441
(FAD_binding_7)
4 TYR A 236
PRO A 254
PHE A  62
TRP A 255
FAD  A 500 (-4.5A)
None
None
None
1.36A 3bjwD-1np7A:
undetectable
3bjwD-1np7A:
13.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1qvb BETA-GLYCOSIDASE

(Thermosphaera
aggregans)
PF00232
(Glyco_hydro_1)
4 LYS A 283
ASN A 376
LYS A 372
PRO A 417
None
1.47A 3bjwD-1qvbA:
0.0
3bjwD-1qvbA:
16.89
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.
1qvb BETA-GLYCOSIDASE

(Thermosphaera
aggregans)
PF00232
(Glyco_hydro_1)
4 TYR A 150
ASN A 207
PHE A 440
TRP A 424
None
1.46A 3bjwD-1qvbA:
0.0
3bjwD-1qvbA:
16.89
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.
1s5j DNA POLYMERASE I

(Sulfolobus
solfataricus)
PF00136
(DNA_pol_B)
PF03104
(DNA_pol_B_exo1)
4 TYR A 460
ASN A 160
LYS A 157
PRO A 138
None
None
SO4  A 883 (-4.5A)
SO4  A 883 (-4.4A)
1.39A 3bjwD-1s5jA:
undetectable
3bjwD-1s5jA:
9.29
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1s8h PHOSPHOLIPASE A2
HOMOLOG


(Agkistrodon
contortrix)
PF00068
(Phospholip_A2_1)
4 LYS A  16
TYR A 113
ASN A 114
LYS A 115
None
0.92A 3bjwD-1s8hA:
20.3
3bjwD-1s8hA:
62.30
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.
1tr1 BETA-GLUCOSIDASE A

(Paenibacillus
polymyxa)
PF00232
(Glyco_hydro_1)
4 TYR A 120
ASN A 165
PHE A 414
TRP A 398
None
None
GOL  A2000 (-3.9A)
GOL  A2000 (-3.2A)
1.49A 3bjwD-1tr1A:
undetectable
3bjwD-1tr1A:
11.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1tz9 MANNONATE
DEHYDRATASE


(Enterococcus
faecalis)
PF03786
(UxuA)
4 ASN A 224
LYS A 223
PRO A 211
PHE A 130
None
0.85A 3bjwD-1tz9A:
undetectable
3bjwD-1tz9A:
16.41
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.
1v87 DELTEX PROTEIN 2

(Mus musculus)
PF00097
(zf-C3HC4)
4 TYR A  74
ASN A  78
LYS A  79
TRP A 101
None
1.25A 3bjwD-1v87A:
undetectable
3bjwD-1v87A:
19.35
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1vip PHOSPHOLIPASE A2

(Daboia russelii)
PF00068
(Phospholip_A2_1)
4 LYS A  16
TYR A 113
LYS A 115
PRO A 121
None
0.86A 3bjwD-1vipA:
20.8
3bjwD-1vipA:
49.18
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.
1wzo HPCE

(Thermus
thermophilus)
PF01557
(FAA_hydrolase)
4 ASN A 240
LYS A  82
PRO A  40
PHE A  41
None
1.48A 3bjwD-1wzoA:
undetectable
3bjwD-1wzoA:
18.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1zt5 INSULIN-LIKE GROWTH
FACTOR BINDING
PROTEIN 1


(Homo sapiens)
PF00086
(Thyroglobulin_1)
4 TYR A 212
ASN A 235
LYS A 237
PRO A 240
None
1.39A 3bjwD-1zt5A:
undetectable
3bjwD-1zt5A:
23.31
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.
2asn NITROPHORIN 2

(Rhodnius
prolixus)
PF02087
(Nitrophorin)
4 TYR X  58
ASN X  59
LYS X  63
LYS X  62
None
1.39A 3bjwD-2asnX:
undetectable
3bjwD-2asnX:
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.
2bx7 DIHYDROOROTATE
DEHYDROGENASE


(Lactococcus
lactis)
PF01180
(DHO_dh)
4 ASN A  90
LYS A  88
PRO A  95
PHE A  11
None
1.48A 3bjwD-2bx7A:
undetectable
3bjwD-2bx7A:
16.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2d1g ACID PHOSPHATASE

(Francisella
tularensis)
PF04185
(Phosphoesterase)
4 TYR A 353
PRO A 290
PHE A 291
TRP A 252
None
1.39A 3bjwD-2d1gA:
undetectable
3bjwD-2d1gA:
11.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2i9u CYTOSINE/GUANINE
DEAMINASE RELATED
PROTEIN


(Clostridium
acetobutylicum)
PF01979
(Amidohydro_1)
4 LYS A 245
LYS A 241
PRO A 205
PHE A 203
None
None
None
GUN  A 503 (-3.5A)
1.50A 3bjwD-2i9uA:
undetectable
3bjwD-2i9uA:
16.15
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.
2j4d CRYPTOCHROME DASH

(Arabidopsis
thaliana)
PF00875
(DNA_photolyase)
PF03441
(FAD_binding_7)
4 TYR A 272
PRO A 290
PHE A  97
TRP A 291
FAD  A1498 (-4.6A)
None
None
None
1.39A 3bjwD-2j4dA:
undetectable
3bjwD-2j4dA:
13.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2oq2 PHOSPHOADENOSINE
PHOSPHOSULFATE
REDUCTASE


(Saccharomyces
cerevisiae)
PF01507
(PAPS_reduct)
4 LYS A  95
ASN A 202
PRO A  30
TRP A 190
None
1.13A 3bjwD-2oq2A:
undetectable
3bjwD-2oq2A:
16.33
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2qhe PHOSPHOLIPASE A2

(Echis carinatus)
PF00068
(Phospholip_A2_1)
4 LYS A  16
TYR A 113
ASN A 114
PRO A 121
None
1.29A 3bjwD-2qheA:
22.8
3bjwD-2qheA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2qhe PHOSPHOLIPASE A2

(Echis carinatus)
PF00068
(Phospholip_A2_1)
4 LYS A 116
PRO A 121
PHE A 124
TRP A 125
None
0.96A 3bjwD-2qheA:
22.8
3bjwD-2qheA:
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.
2qq6 MANDELATE
RACEMASE/MUCONATE
LACTONIZING
ENZYME-LIKE PROTEIN


(Rubrobacter
xylanophilus)
PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C)
4 TYR A 269
LYS A 292
PRO A 315
PHE A 337
None
1.46A 3bjwD-2qq6A:
undetectable
3bjwD-2qq6A:
17.16
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.
2rdy BH0842 PROTEIN

(Bacillus
halodurans)
PF14498
(Glyco_hyd_65N_2)
4 TYR A  88
ASN A 423
PRO A 505
TRP A 446
None
1.21A 3bjwD-2rdyA:
undetectable
3bjwD-2rdyA:
9.54
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.
2vxr BOTULINUM NEUROTOXIN
TYPE G


(Clostridium
botulinum)
PF07951
(Toxin_R_bind_C)
PF07953
(Toxin_R_bind_N)
4 LYS A 943
TYR A1142
ASN A1134
PRO A1131
GOL  A2005 (-4.0A)
None
None
None
1.47A 3bjwD-2vxrA:
undetectable
3bjwD-2vxrA:
12.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2y8d ERYTHROCYTE MEMBRANE
PROTEIN 1


(Plasmodium
falciparum)
PF05424
(Duffy_binding)
4 TYR A2411
PRO A2496
PHE A2495
TRP A2473
None
1.37A 3bjwD-2y8dA:
undetectable
3bjwD-2y8dA:
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.
3b9t TWIN-ARGININE
TRANSLOCATION
PATHWAY SIGNAL
PROTEIN


(Methylobacillus
flagellatus)
PF03069
(FmdA_AmdA)
4 LYS A 274
ASN A 113
PRO A 263
TRP A  84
EDO  A 496 (-2.7A)
None
None
None
1.49A 3bjwD-3b9tA:
undetectable
3bjwD-3b9tA:
15.93
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.
3c9f 5'-NUCLEOTIDASE

(Candida
albicans)
PF00149
(Metallophos)
4 TYR A 348
ASN A 347
LYS A 396
PRO A 398
None
1.43A 3bjwD-3c9fA:
undetectable
3bjwD-3c9fA:
10.83
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3dih PHOSPHOLIPASE A2
HOMOLOG, AMMODYTIN L


(Vipera
ammodytes)
PF00068
(Phospholip_A2_1)
4 LYS A  15
TYR A 103
ASN A 104
LYS A 105
None
1.07A 3bjwD-3dihA:
22.0
3bjwD-3dihA:
64.75
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3dih PHOSPHOLIPASE A2
HOMOLOG, AMMODYTIN L


(Vipera
ammodytes)
PF00068
(Phospholip_A2_1)
4 LYS A  15
TYR A 103
ASN A 104
LYS A 106
None
1.20A 3bjwD-3dihA:
22.0
3bjwD-3dihA:
64.75
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3dih PHOSPHOLIPASE A2
HOMOLOG, AMMODYTIN L


(Vipera
ammodytes)
PF00068
(Phospholip_A2_1)
4 LYS A  15
TYR A 103
LYS A 106
PHE A 113
None
1.43A 3bjwD-3dihA:
22.0
3bjwD-3dihA:
64.75
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.
3fd2 SITE-SPECIFIC DNA
ENDONUCLEASE I-MSOI


(Monomastix sp.
OKE-1)
PF00961
(LAGLIDADG_1)
4 ASN A 109
LYS A 106
LYS A 105
PHE A  48
None
1.08A 3bjwD-3fd2A:
undetectable
3bjwD-3fd2A:
14.86
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.
3fd2 SITE-SPECIFIC DNA
ENDONUCLEASE I-MSOI


(Monomastix sp.
OKE-1)
PF00961
(LAGLIDADG_1)
4 ASN A 312
LYS A 309
LYS A 308
PHE A 251
None
1.06A 3bjwD-3fd2A:
undetectable
3bjwD-3fd2A:
14.86
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.
3gkj NIEMANN-PICK C1
PROTEIN


(Homo sapiens)
PF16414
(NPC1_N)
4 ASN A 198
LYS A 196
PRO A 207
PHE A 209
HC3  A 253 ( 3.8A)
None
None
None
1.39A 3bjwD-3gkjA:
undetectable
3bjwD-3gkjA:
21.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gnr OS03G0212800 PROTEIN

(Oryza sativa)
PF00232
(Glyco_hydro_1)
4 TYR A 131
ASN A 177
PHE A 460
TRP A 444
TYR  A 131 ( 1.3A)
ASN  A 177 (-0.6A)
PHE  A 460 (-1.3A)
TRP  A 444 (-0.5A)
1.42A 3bjwD-3gnrA:
undetectable
3bjwD-3gnrA:
12.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gq9 PRENECK APPENDAGE
PROTEIN


(Bacillus virus
phi29)
PF11962
(Peptidase_G2)
PF12708
(Pectate_lyase_3)
4 ASN A 393
LYS A 394
PRO A 300
PHE A 277
None
1.34A 3bjwD-3gq9A:
undetectable
3bjwD-3gq9A:
11.03
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.
3icf SERINE/THREONINE-PRO
TEIN PHOSPHATASE T


(Saccharomyces
cerevisiae)
PF00149
(Metallophos)
PF08321
(PPP5)
4 ASN A 317
LYS A 318
PRO A 382
PHE A 388
None
1.26A 3bjwD-3icfA:
undetectable
3bjwD-3icfA:
17.25
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.
3j70 ENVELOPE
GLYCOPROTEIN GP120


(Human
immunodeficiency
virus 1)
PF00516
(GP120)
4 ASN D 392
LYS D 362
PHE D 396
TRP D 400
None
1.48A 3bjwD-3j70D:
undetectable
3bjwD-3j70D:
13.44
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.
3j9e VP5

(Bluetongue
virus)
PF00901
(Orbi_VP5)
4 LYS D   3
ASN D 434
PRO D 370
TRP D 371
None
1.31A 3bjwD-3j9eD:
undetectable
3bjwD-3j9eD:
11.89
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.
3jb9 PRE-MRNA-PROCESSING
FACTOR 17
PRE-MRNA-SPLICING
FACTOR CWF5


(Schizosaccharomyces
pombe)
PF01423
(LSM)
PF08082
(PRO8NT)
PF08083
(PROCN)
PF10596
(U6-snRNA_bdg)
PF10597
(U5_2-snRNA_bdg)
PF10598
(RRM_4)
PF12134
(PRP8_domainIV)
4 ASN g  83
LYS g  82
PRO a  20
PHE a  54
None
1.49A 3bjwD-3jb9g:
undetectable
3bjwD-3jb9g:
13.51
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.
3jd8 NIEMANN-PICK C1
PROTEIN


(Homo sapiens)
PF02460
(Patched)
PF12349
(Sterol-sensing)
PF16414
(NPC1_N)
4 ASN A 198
LYS A 196
PRO A 207
PHE A 209
CLR  A1325 ( 3.9A)
None
None
None
1.42A 3bjwD-3jd8A:
undetectable
3bjwD-3jd8A:
7.25
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.
3k2i ACYL-COENZYME A
THIOESTERASE 4


(Homo sapiens)
PF04775
(Bile_Hydr_Trans)
PF08840
(BAAT_C)
4 ASN A 305
LYS A 304
PRO A 310
PHE A 244
None
1.38A 3bjwD-3k2iA:
undetectable
3bjwD-3k2iA:
12.71
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.
3mpp BOTULINUM NEUROTOXIN
TYPE G


(Clostridium
botulinum)
PF07951
(Toxin_R_bind_C)
PF07953
(Toxin_R_bind_N)
4 LYS G 943
TYR G1142
ASN G1134
PRO G1131
None
1.49A 3bjwD-3mppG:
undetectable
3bjwD-3mppG:
12.61
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.
3p1u SUSD HOMOLOG

(Parabacteroides
distasonis)
PF12741
(SusD-like)
4 ASN A 290
LYS A 316
PRO A 319
PHE A 411
None
1.33A 3bjwD-3p1uA:
undetectable
3bjwD-3p1uA:
11.81
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.
3ryk DTDP-4-DEHYDRORHAMNO
SE 3,5-EPIMERASE


(Bacillus
anthracis)
PF00908
(dTDP_sugar_isom)
4 TYR A  30
ASN A  31
LYS A  32
LYS A  33
None
1.15A 3bjwD-3rykA:
undetectable
3bjwD-3rykA:
20.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3vas PUTATIVE ADENOSINE
KINASE


(Schistosoma
mansoni)
PF00294
(PfkB)
4 TYR A  97
ASN A 100
LYS A  99
PHE A  81
None
1.32A 3bjwD-3vasA:
undetectable
3bjwD-3vasA:
13.94
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.
3vup BETA-1,4-MANNANASE

(Aplysia kurodai)
PF00150
(Cellulase)
4 TYR A 102
LYS A  49
LYS A  50
PHE A 308
None
1.46A 3bjwD-3vupA:
undetectable
3bjwD-3vupA:
14.33
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.
3vuu ERYTHROCYTE MEMBRANE
PROTEIN, PUTATIVE


(Plasmodium
falciparum)
PF05424
(Duffy_binding)
4 TYR A 337
ASN A 339
PRO A 344
PHE A 346
None
1.45A 3bjwD-3vuuA:
undetectable
3bjwD-3vuuA:
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.
4bfe CELL SURFACE
GLYCOPROTEIN CD200
RECEPTOR 4


(Mus musculus)
PF07686
(V-set)
PF08205
(C2-set_2)
4 TYR A  62
ASN A  63
LYS A  67
LYS A  66
NAG  A 690 (-4.9A)
None
None
None
1.25A 3bjwD-4bfeA:
undetectable
3bjwD-4bfeA:
17.54
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.
4ewt PEPTIDASE,
M20/M25/M40 FAMILY


(Staphylococcus
aureus)
PF01546
(Peptidase_M20)
PF07687
(M20_dimer)
4 TYR A 293
ASN A 294
PRO A 142
PHE A  31
None
1.48A 3bjwD-4ewtA:
undetectable
3bjwD-4ewtA:
16.13
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.
4fbq DNA REPAIR AND
TELOMERE MAINTENANCE
PROTEIN NBS1,DNA
REPAIR PROTEIN RAD32
CHIMERIC PROTEIN


(Schizosaccharomyces
pombe)
PF00149
(Metallophos)
PF04152
(Mre11_DNA_bind)
4 TYR A1260
ASN A1261
LYS A1265
PHE A1205
None
1.20A 3bjwD-4fbqA:
undetectable
3bjwD-4fbqA:
14.10
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.
4g4s PROTEASOME ASSEMBLY
CHAPERONE 2


(Saccharomyces
cerevisiae)
PF09754
(PAC2)
4 TYR P  74
ASN P  75
LYS P  76
LYS P  77
None
1.20A 3bjwD-4g4sP:
undetectable
3bjwD-4g4sP:
15.71
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.
4gf0 GLUTATHIONE
S-TRANSFERASE


(Sulfitobacter
sp. NAS-14.1)
PF02798
(GST_N)
PF13410
(GST_C_2)
4 LYS A 112
ASN A 170
PRO A 163
PHE A 158
None
1.33A 3bjwD-4gf0A:
undetectable
3bjwD-4gf0A:
18.78
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.
4hea NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT 12


(Thermus
thermophilus)
PF00361
(Proton_antipo_M)
PF00662
(Proton_antipo_N)
4 TYR L 297
LYS L 293
LYS L 292
PHE L 425
None
1.41A 3bjwD-4heaL:
undetectable
3bjwD-4heaL:
9.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4hvf GREEN FLUORESCENT
PROTEIN BLFP-Y6


(Branchiostoma
lanceolatum)
PF01353
(GFP)
4 ASN A 150
LYS A 180
PRO A  74
PHE A  67
None
1.45A 3bjwD-4hvfA:
undetectable
3bjwD-4hvfA:
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.
4hw8 BACTERIAL
EXTRACELLULAR
SOLUTE-BINDING
PROTEIN, PUTATIVE


(Staphylococcus
aureus)
PF13416
(SBP_bac_8)
4 TYR A 158
ASN A 159
LYS A 160
LYS A 161
None
1.29A 3bjwD-4hw8A:
undetectable
3bjwD-4hw8A:
14.25
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.
4iss ALLOPHANATE
HYDROLASE


(Kluyveromyces
lactis)
PF01425
(Amidase)
4 TYR A 148
ASN A 381
PRO A 272
TRP A 265
None
1.42A 3bjwD-4issA:
undetectable
3bjwD-4issA:
11.37
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.
4j3b M1 FAMILY
AMINOPEPTIDASE


(Plasmodium
falciparum)
PF01433
(Peptidase_M1)
PF11940
(DUF3458)
PF17432
(DUF3458_C)
4 TYR A1077
ASN A1073
PRO A 459
PHE A 457
None
None
ARG  A1101 (-3.9A)
None
1.21A 3bjwD-4j3bA:
undetectable
3bjwD-4j3bA:
9.45
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.
4j3o OUTER MEMBRANE USHER
PROTEIN FIMD


(Escherichia
coli)
PF00577
(Usher)
PF13953
(PapC_C)
PF13954
(PapC_N)
4 TYR D 418
ASN D 419
LYS D 420
PRO D 254
None
1.41A 3bjwD-4j3oD:
undetectable
3bjwD-4j3oD:
8.47
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.
4jge RED FLUORESCENT
PROTEIN BLFP-R5


(Branchiostoma
lanceolatum)
PF01353
(GFP)
4 ASN A 150
LYS A 180
PRO A  74
PHE A  67
None
1.41A 3bjwD-4jgeA:
undetectable
3bjwD-4jgeA:
19.14
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.
4ptx GLYCOSIDE HYDROLASE
FAMILY 1


(Halothermothrix
orenii)
PF00232
(Glyco_hydro_1)
4 TYR A 120
ASN A 165
PHE A 417
TRP A 401
None
BGC  A 501 (-3.3A)
BGC  A 501 (-3.8A)
BGC  A 501 (-3.6A)
1.43A 3bjwD-4ptxA:
undetectable
3bjwD-4ptxA:
13.11
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.
4qlz SJCHGC07024 PROTEIN

(Schistosoma
japonicum)
PF00719
(Pyrophosphatase)
4 LYS A 152
TYR A  91
PRO A  65
PHE A  16
CO  A 404 ( 3.2A)
PO4  A 405 (-4.6A)
None
None
1.27A 3bjwD-4qlzA:
undetectable
3bjwD-4qlzA:
17.19
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.
4rm9 EZRIN

(Homo sapiens)
PF00373
(FERM_M)
PF00769
(ERM)
PF09379
(FERM_N)
PF09380
(FERM_C)
4 TYR A 270
ASN A 210
LYS A 211
LYS A 212
None
1.46A 3bjwD-4rm9A:
undetectable
3bjwD-4rm9A:
10.22
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.
4ry9 PERIPLASMIC BINDING
PROTEIN/LACI
TRANSCRIPTIONAL
REGULATOR


(Verminephrobacter
eiseniae)
PF13407
(Peripla_BP_4)
4 LYS A 270
TYR A 324
ASN A 325
LYS A 327
None
1.37A 3bjwD-4ry9A:
undetectable
3bjwD-4ry9A:
15.25
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.
4ug4 CHOLINE SULFATASE

(Sinorhizobium
meliloti)
PF00884
(Sulfatase)
PF12411
(Choline_sulf_C)
4 TYR A 123
ASN A  75
PRO A  52
PHE A 312
None
1.46A 3bjwD-4ug4A:
undetectable
3bjwD-4ug4A:
12.70
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4wtb BASIC PHOSPHOLIPASE
A2 HOMOLOG
BOTHROPSTOXIN-1


(Bothrops
jararacussu)
PF00068
(Phospholip_A2_1)
4 LYS A  15
TYR A 103
ASN A 104
LYS A 105
None
1.02A 3bjwD-4wtbA:
20.5
3bjwD-4wtbA:
56.56
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4wtb BASIC PHOSPHOLIPASE
A2 HOMOLOG
BOTHROPSTOXIN-1


(Bothrops
jararacussu)
PF00068
(Phospholip_A2_1)
4 LYS A  15
TYR A 103
ASN A 104
PHE A 114
None
0.98A 3bjwD-4wtbA:
20.5
3bjwD-4wtbA:
56.56
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.
4xr7 PAB-DEPENDENT
POLY(A)-SPECIFIC
RIBONUCLEASE SUBUNIT
PAN2
PAB-DEPENDENT
POLY(A)-SPECIFIC
RIBONUCLEASE SUBUNIT
PAN3


(Saccharomyces
cerevisiae)
no annotation 4 TYR G 812
ASN G 813
LYS G 815
PHE L 552
None
0.93A 3bjwD-4xr7G:
undetectable
3bjwD-4xr7G:
10.54
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.
4y1y GALECTIN-1

(Homo sapiens)
PF00337
(Gal-bind_lectin)
4 ASN A  33
LYS A  43
PRO A  47
PHE A  79
None
CSO  A  42 ( 3.6A)
None
None
1.41A 3bjwD-4y1yA:
undetectable
3bjwD-4y1yA:
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.
4yeh LECTIN

(Cicer arietinum)
PF00045
(Hemopexin)
4 LYS A 136
ASN A  81
LYS A 103
PRO A 101
None
1.47A 3bjwD-4yehA:
undetectable
3bjwD-4yehA:
19.27
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.
4zhb ANKYRIN
REPEAT-CONTAINING
PROTEIN


(Legionella
pneumophila)
PF12796
(Ank_2)
4 TYR A  50
ASN A  83
LYS A  86
PHE A 102
None
1.31A 3bjwD-4zhbA:
undetectable
3bjwD-4zhbA:
16.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4zpi PUTATIVE
OXIDASE/HYDROXYLASE


(Streptomyces
hygroscopicus)
PF05721
(PhyH)
4 ASN A 105
LYS A 161
PRO A 134
PHE A 229
None
0.96A 3bjwD-4zpiA:
undetectable
3bjwD-4zpiA:
17.05
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.
5c24 HIV-1 REVERSE
TRANSCRIPTASE, P51
SUBUNIT


(Human
immunodeficiency
virus 1)
PF00078
(RVT_1)
PF06815
(RVT_connect)
PF06817
(RVT_thumb)
4 LYS B 166
PRO B 150
PHE B  77
TRP B 153
None
1.32A 3bjwD-5c24B:
undetectable
3bjwD-5c24B:
14.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5c2m PREDICTED PROTEIN

(Nematostella
vectensis)
PF14517
(Tachylectin)
4 ASN A 230
LYS A 215
LYS A 216
TRP A 192
None
1.39A 3bjwD-5c2mA:
undetectable
3bjwD-5c2mA:
18.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5cg0 BETA-GLUCOSIDASE

(Spodoptera
frugiperda)
PF00232
(Glyco_hydro_1)
4 TYR A 141
ASN A 186
PHE A 460
TRP A 444
None
None
TRS  A 603 (-4.1A)
TRS  A 603 ( 4.2A)
1.45A 3bjwD-5cg0A:
undetectable
3bjwD-5cg0A:
14.86
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.
5fgl NICR

(Pseudomonas
putida)
PF00440
(TetR_N)
4 TYR A  94
ASN A  93
LYS A  90
LYS A  89
None
1.36A 3bjwD-5fglA:
undetectable
3bjwD-5fglA:
16.75
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.
5g4x SH3 AND MULTIPLE
ANKYRIN REPEAT
DOMAINS PROTEIN 3


(Rattus
norvegicus)
PF12796
(Ank_2)
PF16511
(FERM_f0)
4 TYR A  53
ASN A  52
PRO A 141
PHE A 119
EDO  A1354 (-4.6A)
None
None
None
1.49A 3bjwD-5g4xA:
undetectable
3bjwD-5g4xA:
14.54
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.
5i8i UREA AMIDOLYASE

(Kluyveromyces
lactis)
PF00289
(Biotin_carb_N)
PF01425
(Amidase)
PF02626
(CT_A_B)
PF02682
(CT_C_D)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2)
4 TYR A 148
ASN A 381
PRO A 272
TRP A 265
None
1.42A 3bjwD-5i8iA:
undetectable
3bjwD-5i8iA:
4.91
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.
5idi 1,4-BETA-D-GLUCAN
GLUCOHYDROLASE


(Thermotoga
neapolitana)
PF00232
(Glyco_hydro_1)
4 TYR A 118
ASN A 163
PHE A 412
TRP A 396
None
None
ACT  A 501 ( 4.0A)
ACT  A 501 (-3.4A)
1.44A 3bjwD-5idiA:
undetectable
3bjwD-5idiA:
12.08
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.
5k8b 8-AMINO-3,8-DIDEOXY-
ALPHA-D-MANNO-OCTULO
SONATE TRANSAMINASE


(Shewanella
oneidensis)
PF01041
(DegT_DnrJ_EryC1)
4 ASN A 261
LYS A 262
PRO A   2
PHE A   4
None
CL  A 503 (-3.0A)
None
None
1.22A 3bjwD-5k8bA:
undetectable
3bjwD-5k8bA:
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.
5l9w ACETOPHENONE
CARBOXYLASE BETA
SUBUNIT
ACETOPHENONE
CARBOXYLASE DELTA
SUBUNIT


(Aromatoleum
aromaticum)
PF02538
(Hydantoinase_B)
PF08882
(Acetone_carb_G)
4 TYR C  36
LYS C  37
LYS C  38
PRO A 648
None
1.44A 3bjwD-5l9wC:
undetectable
3bjwD-5l9wC:
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.
5lfr MYELIN-ASSOCIATED
GLYCOPROTEIN


(Mus musculus)
PF08205
(C2-set_2)
PF13927
(Ig_3)
4 ASN A 266
LYS A 237
PRO A 206
PHE A 204
None
1.17A 3bjwD-5lfrA:
undetectable
3bjwD-5lfrA:
14.47
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.
5m86 TA1207

(Thermoplasma
acidophilum)
no annotation 4 TYR A 214
LYS A 204
PRO A  42
PHE A  52
None
1.44A 3bjwD-5m86A:
undetectable
3bjwD-5m86A:
14.11
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.
5mlc 50S RIBOSOMAL
PROTEIN L3,
CHLOROPLASTIC


(Spinacia
oleracea)
PF00297
(Ribosomal_L3)
4 ASN E 301
LYS E 296
PRO E 294
PHE E 191
None
C  A2789 ( 2.7A)
None
None
1.46A 3bjwD-5mlcE:
undetectable
3bjwD-5mlcE:
14.71
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.
5n8o DNA HELICASE I

(Escherichia
coli)
PF07057
(TraI)
PF08751
(TrwC)
PF13604
(AAA_30)
4 TYR A  16
PRO A 154
PHE A 234
TRP A 277
None
1.29A 3bjwD-5n8oA:
undetectable
3bjwD-5n8oA:
4.80
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.
5o9h C5A ANAPHYLATOXIN
CHEMOTACTIC RECEPTOR
1


(Homo sapiens)
no annotation 4 TYR A 181
LYS A 185
PRO A 103
PHE A 104
None
1.45A 3bjwD-5o9hA:
undetectable
3bjwD-5o9hA:
15.57
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.
5ogz -

(-)
no annotation 4 TYR A 120
ASN A 165
PHE A 418
TRP A 402
None
1.48A 3bjwD-5ogzA:
undetectable
3bjwD-5ogzA:
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.
5owc -

(-)
no annotation 4 TYR A 103
LYS A 106
PRO A 111
PHE A 113
PEG  A 205 ( 4.2A)
None
None
None
1.47A 3bjwD-5owcA:
18.7
3bjwD-5owcA:
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.
5uam ULVAN LYASE-PL25

(Pseudoalteromonas
sp. PLSV)
PF15892
(BNR_4)
4 LYS A 432
TYR A 466
LYS A 464
PRO A  84
None
1.46A 3bjwD-5uamA:
undetectable
3bjwD-5uamA:
13.36
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.
5xgz BETA-GLYCOSIDASE

(uncultured
microorganism)
no annotation 4 TYR A 124
ASN A 169
PHE A 419
TRP A 403
None
None
GOL  A 501 (-4.3A)
GOL  A 501 (-3.5A)
1.42A 3bjwD-5xgzA:
undetectable
3bjwD-5xgzA:
16.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5y5a KLLA0F20702P

(Kluyveromyces
lactis)
no annotation 4 ASN A 471
LYS A 470
PRO A 526
PHE A 524
None
1.30A 3bjwD-5y5aA:
undetectable
3bjwD-5y5aA:
15.70
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.
5zal ENDORIBONUCLEASE
DICER


(Homo sapiens)
no annotation 4 LYS A  79
TYR A1692
ASN A1695
PHE A1610
None
1.02A 3bjwD-5zalA:
undetectable
3bjwD-5zalA:
22.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6epe PROTEASOME (PROSOME,
MACROPAIN) 26S
SUBUNIT, NON-ATPASE,
7 (PREDICTED)


(Rattus
norvegicus)
no annotation 4 LYS U  84
ASN U  77
PRO U  57
PHE U  69
None
1.20A 3bjwD-6epeU:
undetectable
3bjwD-6epeU:
18.80
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.
6gdt -

(-)
no annotation 4 LYS A 510
ASN A 496
PRO A 484
PHE A  62
None
1.38A 3bjwD-6gdtA:
undetectable
3bjwD-6gdtA:
undetectable