SIMILAR PATTERNS OF AMINO ACIDS FOR 2W1B_A_DXCA2034_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.
1a25 PROTEIN KINASE C
(BETA)

(Rattus
norvegicus) 		PF00168
(C2) 		3 PHE A 255
SER A 241
LEU A 259
 None
 0.83A 2w1bA-1a25A:
0.0		 2w1bA-1a25A:
9.29
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.
1epx FRUCTOSE-1,6-BISPHOS
PHATE ALDOLASE

(Leishmania
mexicana) 		PF00274
(Glycolytic) 		3 PHE A 154
SER A 310
LEU A  40
 None
 0.71A 2w1bA-1epxA:
0.0		 2w1bA-1epxA:
15.85
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.
1f2j FRUCTOSE-BISPHOSPHAT
E ALDOLASE,
GLYCOSOMAL

(Trypanosoma
brucei) 		PF00274
(Glycolytic) 		3 PHE A 154
SER A 310
LEU A  40
 None
 0.78A 2w1bA-1f2jA:
0.0		 2w1bA-1f2jA:
15.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1fba FRUCTOSE
1,6-BISPHOSPHATE
ALDOLASE

(Drosophila
melanogaster) 		PF00274
(Glycolytic) 		3 PHE A 144
SER A 300
LEU A  30
 None
 0.75A 2w1bA-1fbaA:
0.0		 2w1bA-1fbaA:
16.07
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.
1fdj FRUCTOSE
1,6-BISPHOSPHATE
ALDOLASE

(Oryctolagus
cuniculus) 		PF00274
(Glycolytic) 		3 PHE A1144
SER A1300
LEU A1030
 None
 0.60A 2w1bA-1fdjA:
0.0		 2w1bA-1fdjA:
16.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1pu7 3-METHYLADENINE DNA
GLYCOSYLASE

(Helicobacter
pylori) 		PF00633
(HHH)
PF00730
(HhH-GPD) 		3 PHE A 174
SER A 210
LEU A 155
 None
 0.80A 2w1bA-1pu7A:
undetectable		 2w1bA-1pu7A:
12.41
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.
1q40 MRNA TRANSPORT
REGULATOR MTR2

(Candida
albicans) 		PF10429
(Mtr2) 		3 PHE A  71
SER A  19
LEU A  17
 None
 0.77A 2w1bA-1q40A:
0.0		 2w1bA-1q40A:
9.93
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.
1v6t HYPOTHETICAL UPF0271
PROTEIN PH0986

(Pyrococcus
horikoshii) 		PF03746
(LamB_YcsF) 		3 PHE A 253
SER A  30
LEU A   5
 None
 0.60A 2w1bA-1v6tA:
0.0		 2w1bA-1v6tA:
12.60
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.
1wcd MAJOR STRUCTURAL
PROTEIN VP2

(Infectious
bursal disease
virus) 		PF01766
(Birna_VP2) 		3 PHE J 371
SER J  43
LEU J  87
 None
 0.79A 2w1bA-1wcdJ:
0.1		 2w1bA-1wcdJ:
18.70
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.
1x9d ENDOPLASMIC
RETICULUM
MANNOSYL-OLIGOSACCHA
RIDE
1,2-ALPHA-MANNOSIDAS
E

(Homo sapiens) 		PF01532
(Glyco_hydro_47) 		3 PHE A 307
SER A 341
LEU A 339
 None
 0.80A 2w1bA-1x9dA:
0.0		 2w1bA-1x9dA:
20.28
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.
1xfb ALDOLASE C

(Homo sapiens) 		PF00274
(Glycolytic) 		3 PHE A 145
SER A 301
LEU A  31
 None
 0.73A 2w1bA-1xfbA:
undetectable		 2w1bA-1xfbA:
18.53
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.
1xx4 3,2-TRANS-ENOYL-COA
ISOMERASE,
MITOCHONDRIAL

(Rattus
norvegicus) 		PF00378
(ECH_1) 		3 PHE A 267
SER A 276
LEU A 168
 BAM  A 600 (-3.5A)
None
None
 0.74A 2w1bA-1xx4A:
undetectable		 2w1bA-1xx4A:
13.45
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.
1yb1 17-BETA-HYDROXYSTERO
ID DEHYDROGENASE
TYPE XI

(Homo sapiens) 		PF00106
(adh_short) 		3 PHE A  51
SER A 110
LEU A 112
 None
 0.82A 2w1bA-1yb1A:
undetectable		 2w1bA-1yb1A:
14.19
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.
1ypz T-CELL RECEPTOR
GAMMA CHAIN

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		3 PHE F 225
SER F 193
LEU F 153
 None
 0.80A 2w1bA-1ypzF:
undetectable		 2w1bA-1ypzF:
12.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1z5x ECDYSONE RECEPTOR
LIGAND BINDING
DOMAIN

(Bemisia tabaci) 		PF00104
(Hormone_recep) 		3 PHE E 311
SER E 378
LEU E 376
 None
 0.77A 2w1bA-1z5xE:
undetectable		 2w1bA-1z5xE:
14.69
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.
1zap SECRETED ASPARTIC
PROTEINASE

(Candida
albicans) 		PF00026
(Asp) 		3 PHE A 279
SER A 313
LEU A 311
 None
 0.79A 2w1bA-1zapA:
undetectable		 2w1bA-1zapA:
16.81
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.
1zjy R-SPECIFIC ALCOHOL
DEHYDROGENASE

(Lactobacillus
brevis) 		PF13561
(adh_short_C2) 		3 PHE A  26
SER A  84
LEU A  86
 None
 0.81A 2w1bA-1zjyA:
undetectable		 2w1bA-1zjyA:
14.67
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.
1zkd DUF185

(Rhodopseudomonas
palustris) 		PF02636
(Methyltransf_28) 		3 PHE A 303
SER A  71
LEU A  67
 None
 0.66A 2w1bA-1zkdA:
undetectable		 2w1bA-1zkdA:
17.24
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.
1zrz PROTEIN KINASE C,
IOTA

(Homo sapiens) 		PF00069
(Pkinase)
PF00433
(Pkinase_C) 		3 PHE A 513
SER A 486
LEU A 484
 None
 0.82A 2w1bA-1zrzA:
undetectable		 2w1bA-1zrzA:
16.48
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.
1zxx 6-PHOSPHOFRUCTOKINAS
E

(Lactobacillus
delbrueckii) 		PF00365
(PFK) 		3 PHE A  41
SER A 119
LEU A 110
 None
 0.67A 2w1bA-1zxxA:
undetectable		 2w1bA-1zxxA:
16.80
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.
2bc0 NADH OXIDASE

(Streptococcus
pyogenes) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		3 PHE A  61
SER A 148
LEU A 144
 None
 0.55A 2w1bA-2bc0A:
undetectable		 2w1bA-2bc0A:
20.15
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.
2btu PHOSPHORIBOSYL-AMINO
IMIDAZOLE SYNTHETASE

(Bacillus
anthracis) 		PF00586
(AIRS)
PF02769
(AIRS_C) 		3 PHE A 252
SER A 183
LEU A 181
 None
 0.74A 2w1bA-2btuA:
3.4		 2w1bA-2btuA:
18.00
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.
2bw3 TRANSPOSASE

(Musca domestica) 		PF05699
(Dimer_Tnp_hAT)
PF10683
(DBD_Tnp_Hermes) 		3 PHE A 235
SER A 602
LEU A 598
 None
 0.52A 2w1bA-2bw3A:
undetectable		 2w1bA-2bw3A:
19.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2eij CYTOCHROME C OXIDASE
SUBUNIT 1

(Bos taurus) 		PF00115
(COX1) 		3 PHE A  22
SER A 156
LEU A 152
 None
 0.66A 2w1bA-2eijA:
undetectable		 2w1bA-2eijA:
19.15
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.
2fia ACETYLTRANSFERASE

(Enterococcus
faecalis) 		PF00583
(Acetyltransf_1) 		3 PHE A 126
SER A  63
LEU A  95
 None
 0.66A 2w1bA-2fiaA:
undetectable		 2w1bA-2fiaA:
9.66
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.
2fuv PHOSPHOGLUCOMUTASE

(Salmonella
enterica) 		PF00408
(PGM_PMM_IV)
PF02878
(PGM_PMM_I)
PF02879
(PGM_PMM_II)
PF02880
(PGM_PMM_III) 		3 PHE A 376
SER A 351
LEU A 349
 None
 0.66A 2w1bA-2fuvA:
undetectable		 2w1bA-2fuvA:
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.
2fwr DNA REPAIR PROTEIN
RAD25

(Archaeoglobus
fulgidus) 		PF04851
(ResIII)
PF16203
(ERCC3_RAD25_C) 		3 PHE A 198
SER A 216
LEU A 189
 None
 0.75A 2w1bA-2fwrA:
undetectable		 2w1bA-2fwrA:
19.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2hyt TETR-FAMILY
TRANSCRIPTIONAL
REGULATOR

(Pectobacterium
atrosepticum) 		PF00440
(TetR_N) 		3 PHE A  88
SER A 159
LEU A 155
 None
 0.83A 2w1bA-2hytA:
undetectable		 2w1bA-2hytA:
10.91
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.
2inp PHENOL HYDROXYLASE
COMPONENT PHN

(Pseudomonas
stutzeri) 		PF02332
(Phenol_Hydrox)
PF04945
(YHS) 		3 PHE A 408
SER A 277
LEU A 273
 None
 0.81A 2w1bA-2inpA:
1.9		 2w1bA-2inpA:
18.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2nxx ECDYSONE RECEPTOR
(ECR, NRH1)

(Tribolium
castaneum) 		PF00104
(Hormone_recep) 		3 PHE E 442
SER E 509
LEU E 507
 None
 0.76A 2w1bA-2nxxE:
undetectable		 2w1bA-2nxxE:
12.81
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.
2pjz HYPOTHETICAL PROTEIN
ST1066

(Sulfurisphaera
tokodaii) 		PF00005
(ABC_tran) 		3 PHE A 198
SER A 216
LEU A 214
 None
 0.83A 2w1bA-2pjzA:
undetectable		 2w1bA-2pjzA:
15.22
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.
2py6 METHYLTRANSFERASE
FKBM

(Methylobacillus
flagellatus) 		PF05050
(Methyltransf_21) 		3 PHE A 337
SER A 218
LEU A 214
 None
 0.71A 2w1bA-2py6A:
undetectable		 2w1bA-2py6A:
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.
2qzw CANDIDAPEPSIN-1

(Candida
albicans) 		PF00026
(Asp) 		3 PHE A 279
SER A 313
LEU A 311
 None
 0.83A 2w1bA-2qzwA:
undetectable		 2w1bA-2qzwA:
16.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ri6 2-HYDROXY-6-OXO-6-PH
ENYLHEXA-2,4-DIENOAT
E HYDROLASE

(Paraburkholderia
xenovorans) 		PF12697
(Abhydrolase_6) 		3 PHE A  74
SER A 207
LEU A 205
 None
 0.77A 2w1bA-2ri6A:
undetectable		 2w1bA-2ri6A:
14.49
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.
2v7b BENZOATE-COENZYME A
LIGASE

(Paraburkholderia
xenovorans) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		3 PHE A 403
SER A 334
LEU A 338
 None
 0.75A 2w1bA-2v7bA:
3.0		 2w1bA-2v7bA:
21.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2v8j PECTATE LYASE

(Yersinia
enterocolitica) 		PF06917
(Pectate_lyase_2) 		3 PHE A 344
SER A 384
LEU A 382
 None
 0.83A 2w1bA-2v8jA:
undetectable		 2w1bA-2v8jA:
19.13
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.
3bv4 FRUCTOSE-BISPHOSPHAT
E ALDOLASE A

(Oryctolagus
cuniculus) 		PF00274
(Glycolytic) 		3 PHE A 144
SER A 300
LEU A  30
 None
 0.71A 2w1bA-3bv4A:
undetectable		 2w1bA-3bv4A:
16.12
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.
3bxw CHITINASE
DOMAIN-CONTAINING
PROTEIN 1

(Homo sapiens) 		no annotation 3 PHE B 279
SER B 340
LEU B 338
 None
 0.81A 2w1bA-3bxwB:
undetectable		 2w1bA-3bxwB:
16.25
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.
3csk PROBABLE
DIPEPTIDYL-PEPTIDASE
3

(Saccharomyces
cerevisiae) 		PF03571
(Peptidase_M49) 		3 PHE A 109
SER A  55
LEU A  98
 None
 0.79A 2w1bA-3cskA:
2.3		 2w1bA-3cskA:
21.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3guv SITE-SPECIFIC
RECOMBINASE,
RESOLVASE FAMILY
PROTEIN

(Streptococcus
pneumoniae) 		PF00239
(Resolvase) 		3 PHE A  63
SER A  97
LEU A  99
 None
 0.81A 2w1bA-3guvA:
undetectable		 2w1bA-3guvA:
10.28
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.
3if8 PROTEIN ZWILCH
HOMOLOG

(Homo sapiens) 		PF09817
(Zwilch) 		3 PHE B 348
SER B 376
LEU B 372
 None
 0.83A 2w1bA-3if8B:
undetectable		 2w1bA-3if8B:
12.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ivu HOMOCITRATE
SYNTHASE,
MITOCHONDRIAL

(Schizosaccharomyces
pombe) 		PF00682
(HMGL-like) 		3 PHE A  53
SER A 250
LEU A 252
 None
 0.82A 2w1bA-3ivuA:
undetectable		 2w1bA-3ivuA:
17.90
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.
3lkl ANTISIGMA-FACTOR
ANTAGONIST STAS

(Rhodobacter
sphaeroides) 		PF01740
(STAS) 		3 PHE A   1
SER A  57
LEU A  61
 None
 0.81A 2w1bA-3lklA:
undetectable		 2w1bA-3lklA:
5.62
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.
3lwd 6-PHOSPHOGLUCONOLACT
ONASE

(Chromohalobacter
salexigens) 		PF01182
(Glucosamine_iso) 		3 PHE A  97
SER A  78
LEU A  82
 None
 0.83A 2w1bA-3lwdA:
undetectable		 2w1bA-3lwdA:
13.74
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.
3mbf FRUCTOSE-BISPHOSPHAT
E ALDOLASE

(Encephalitozoon
cuniculi) 		PF00274
(Glycolytic) 		3 PHE A 136
SER A 292
LEU A  25
 None
2FP  A 345 (-4.4A)
None
 0.69A 2w1bA-3mbfA:
undetectable		 2w1bA-3mbfA:
15.15
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.
3mfq HIGH-AFFINITY ZINC
UPTAKE SYSTEM
PROTEIN ZNUA

(Streptococcus
suis) 		PF01297
(ZnuA) 		3 PHE A  42
SER A 247
LEU A 278
 None
 0.68A 2w1bA-3mfqA:
undetectable		 2w1bA-3mfqA:
14.81
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.
3mmt FRUCTOSE-BISPHOSPHAT
E ALDOLASE

(Bartonella
henselae) 		PF00274
(Glycolytic) 		3 PHE A 134
SER A 292
LEU A  20
 None
2FP  A 350 ( 4.7A)
None
 0.72A 2w1bA-3mmtA:
undetectable		 2w1bA-3mmtA:
16.83
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.
3naw SECRETED EFFECTOR
PROTEIN

(Escherichia
coli) 		PF00805
(Pentapeptide)
PF13979
(SopA_C)
PF13981
(SopA) 		3 PHE A 433
SER A 411
LEU A 406
 None
 0.70A 2w1bA-3nawA:
undetectable		 2w1bA-3nawA:
20.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3oks 4-AMINOBUTYRATE
TRANSAMINASE

(Mycolicibacterium
smegmatis) 		PF00202
(Aminotran_3) 		3 PHE A 238
SER A  64
LEU A  62
 None
 0.76A 2w1bA-3oksA:
undetectable		 2w1bA-3oksA:
19.76
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.
3pfq PROTEIN KINASE C
BETA TYPE

(Rattus
norvegicus) 		PF00069
(Pkinase)
PF00130
(C1_1)
PF00168
(C2)
PF00433
(Pkinase_C) 		3 PHE A 255
SER A 241
LEU A 259
 None
 0.72A 2w1bA-3pfqA:
undetectable		 2w1bA-3pfqA:
19.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3r4t 4-AMINOBUTYRATE
AMINOTRANSFERASE
GABT

(Mycobacterium
marinum) 		PF00202
(Aminotran_3) 		3 PHE A 237
SER A  63
LEU A  61
 None
 0.83A 2w1bA-3r4tA:
undetectable		 2w1bA-3r4tA:
19.12
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.
3sgz HYDROXYACID OXIDASE
2

(Rattus
norvegicus) 		PF01070
(FMN_dh) 		3 PHE A 199
SER A 105
LEU A 128
 HO6  A 402 ( 4.8A)
FMN  A 401 (-2.8A)
None
 0.77A 2w1bA-3sgzA:
undetectable		 2w1bA-3sgzA:
16.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3sig POLY(ADP-RIBOSE)
GLYCOHYDROLASE

(Thermomonospora
curvata) 		PF10021
(DUF2263) 		3 PHE A 238
SER A 177
LEU A 175
 None
 0.76A 2w1bA-3sigA:
undetectable		 2w1bA-3sigA:
14.46
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.
3v0a NTNH

(Clostridium
botulinum) 		PF01742
(Peptidase_M27)
PF07953
(Toxin_R_bind_N)
PF08470
(NTNH_C) 		3 PHE B 358
SER B 258
LEU B 248
 None
 0.39A 2w1bA-3v0aB:
undetectable		 2w1bA-3v0aB:
20.88
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.
3vkg DYNEIN HEAVY CHAIN,
CYTOPLASMIC

(Dictyostelium
discoideum) 		PF03028
(Dynein_heavy)
PF07728
(AAA_5)
PF08393
(DHC_N2)
PF12774
(AAA_6)
PF12775
(AAA_7)
PF12777
(MT)
PF12780
(AAA_8)
PF12781
(AAA_9) 		3 PHE A1904
SER A4340
LEU A4338
 None
 0.82A 2w1bA-3vkgA:
undetectable		 2w1bA-3vkgA:
15.48
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.
3vuo NTNHA

(Clostridium
botulinum) 		PF01742
(Peptidase_M27)
PF07953
(Toxin_R_bind_N)
PF08470
(NTNH_C) 		3 PHE A 358
SER A 258
LEU A 248
 None
 0.37A 2w1bA-3vuoA:
undetectable		 2w1bA-3vuoA:
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.
3woz CLIP-ASSOCIATING
PROTEIN 2

(Mus musculus) 		no annotation 3 PHE A 766
SER A 839
LEU A 837
 None
 0.82A 2w1bA-3wozA:
undetectable		 2w1bA-3wozA:
12.99
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.
3zx9 CAPSID PROTEIN

(Turnip crinkle
virus) 		PF00729
(Viral_coat) 		3 PHE A 286
SER A 246
LEU A 281
 None
 0.76A 2w1bA-3zx9A:
undetectable		 2w1bA-3zx9A:
17.11
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.
4a8j ELONGATOR COMPLEX
PROTEIN 4

(Saccharomyces
cerevisiae) 		PF05625
(PAXNEB) 		3 PHE A 160
SER A 330
LEU A 122
 None
 0.57A 2w1bA-4a8jA:
undetectable		 2w1bA-4a8jA:
15.80
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.
4bzk PROTEIN TRANSPORT
PROTEIN SEC31

(Saccharomyces
cerevisiae) 		PF00400
(WD40)
PF12931
(Sec16_C) 		3 PHE A 595
SER A 575
LEU A 573
 None
 0.83A 2w1bA-4bzkA:
undetectable		 2w1bA-4bzkA:
22.32
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.
4c8y CAS6A

(Thermus
thermophilus) 		PF10040
(CRISPR_Cas6) 		3 PHE A 122
SER A 146
LEU A 142
 None
G  C  26 ( 3.8A)
G  C  25 ( 4.5A)
 0.69A 2w1bA-4c8yA:
3.2		 2w1bA-4c8yA:
13.08
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.
4c98 CAS6B

(Thermus
thermophilus) 		PF10040
(CRISPR_Cas6) 		3 PHE A 138
SER A 167
LEU A 163
 None
 0.72A 2w1bA-4c98A:
undetectable		 2w1bA-4c98A:
14.70
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.
4f4z DNA POLYMERASE IV

(Sulfolobus
acidocaldarius;
Sulfolobus
solfataricus) 		no annotation 3 PHE B 150
SER B 227
LEU B 225
 None
 0.81A 2w1bA-4f4zB:
3.6		 2w1bA-4f4zB:
16.71
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.
4glk ABIQ

(Lactococcus
lactis) 		PF13958
(ToxN_toxin) 		3 PHE A   5
SER A  52
LEU A  84
 None
 0.55A 2w1bA-4glkA:
undetectable		 2w1bA-4glkA:
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.
4hl7 NICOTINATE
PHOSPHORIBOSYLTRANSF
ERASE

(Vibrio cholerae) 		PF04095
(NAPRTase) 		3 PHE A 402
SER A 247
LEU A 241
 None
 0.83A 2w1bA-4hl7A:
2.3		 2w1bA-4hl7A:
18.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4jre NITRITE EXTRUSION
PROTEIN 1

(Escherichia
coli) 		PF07690
(MFS_1) 		3 PHE A 325
SER A 269
LEU A 264
 None
GYP  A 502 ( 4.8A)
GYP  A 502 (-4.3A)
 0.82A 2w1bA-4jreA:
undetectable		 2w1bA-4jreA:
19.19
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.
4k1x NADPH:FERREDOXIN
REDUCTASE

(Rhodobacter
capsulatus) 		PF00175
(NAD_binding_1)
PF00970
(FAD_binding_6) 		3 PHE A 214
SER A 247
LEU A 245
 None
 0.82A 2w1bA-4k1xA:
undetectable		 2w1bA-4k1xA:
13.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4l9o SEC16,PROTEIN
TRANSPORT PROTEIN
SEC13

(Komagataella
pastoris;
Komagataella
phaffii) 		PF00400
(WD40) 		3 PHE A2256
SER A2294
LEU A2283
 None
 0.81A 2w1bA-4l9oA:
undetectable		 2w1bA-4l9oA:
16.34
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.
4lhu 9C2 TCR GAMMA CHAIN

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set) 		3 PHE G 229
SER G 197
LEU G 157
 None
 0.79A 2w1bA-4lhuG:
undetectable		 2w1bA-4lhuG:
12.97
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.
4nlh TAX1-BINDING PROTEIN
1

(Homo sapiens) 		PF07888
(CALCOCO1) 		3 PHE A  19
SER A  69
LEU A  67
 None
 0.78A 2w1bA-4nlhA:
undetectable		 2w1bA-4nlhA:
9.24
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.
4oiy PROTEIN TRANSPORT
PROTEIN SEC7

(Saccharomyces
cerevisiae) 		PF01369
(Sec7) 		3 PHE A 896
SER A 913
LEU A 915
 None
 0.83A 2w1bA-4oiyA:
undetectable		 2w1bA-4oiyA:
11.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4pii N-GLYCOSYLASE/DNA
LYASE

(Pyrococcus
furiosus) 		PF09171
(AGOG) 		3 PHE A 164
SER A 211
LEU A 207
 None
 0.76A 2w1bA-4piiA:
1.8		 2w1bA-4piiA:
13.06
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.
4ppu CHORISMATE MUTASE 1,
CHLOROPLASTIC

(Arabidopsis
thaliana) 		no annotation 3 PHE A 151
SER A 227
LEU A 223
 None
 0.83A 2w1bA-4ppuA:
3.5		 2w1bA-4ppuA:
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.
4q1v PUTATIVE DIPEPTIDYL
AMINOPEPTIDASE IV

(Bacteroides
ovatus) 		PF00326
(Peptidase_S9)
PF00930
(DPPIV_N) 		3 PHE A 420
SER A 426
LEU A 402
 None
 0.71A 2w1bA-4q1vA:
undetectable		 2w1bA-4q1vA:
19.87
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.
4rl6 SACCHAROPINE
DEHYDROGENASE

(Streptococcus
pneumoniae) 		PF03435
(Sacchrp_dh_NADP)
PF16653
(Sacchrp_dh_C) 		3 PHE A 136
SER A 216
LEU A 248
 None
 0.71A 2w1bA-4rl6A:
undetectable		 2w1bA-4rl6A:
18.20
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.
4rlq BENZOATE-COENZYME A
LIGASE

(Rhodopseudomonas
palustris) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		3 PHE A 397
SER A 328
LEU A 332
 None
 0.73A 2w1bA-4rlqA:
3.8		 2w1bA-4rlqA:
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.
4rt6 HEME/HEMOPEXIN-BINDI
NG PROTEIN

(Haemophilus
influenzae) 		PF05860
(Haemagg_act) 		3 PHE A 182
SER A 175
LEU A 153
 None
 0.81A 2w1bA-4rt6A:
undetectable		 2w1bA-4rt6A:
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.
4tps SPORULATION
INHIBITOR OF
REPLICATION PROTEIN
SIRA
CHROMOSOMAL
REPLICATION
INITIATOR PROTEIN
DNAA

(Bacillus
subtilis;
Bacillus
subtilis) 		PF10747
(SirA)
PF11638
(DnaA_N) 		3 PHE A  14
SER B  56
LEU B  54
 None
 0.79A 2w1bA-4tpsA:
undetectable		 2w1bA-4tpsA:
9.00
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.
4uqm URACIL-DNA
GLYCOSYLASE

(Deinococcus
radiodurans) 		PF03167
(UDG) 		3 PHE A  96
SER A 204
LEU A 182
 None
 0.67A 2w1bA-4uqmA:
undetectable		 2w1bA-4uqmA:
12.96
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.
5apm VP0

(Parechovirus A) 		PF00073
(Rhv) 		3 PHE C 169
SER C 144
LEU C 141
 None
 0.51A 2w1bA-5apmC:
undetectable		 2w1bA-5apmC:
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.
5df0 AC-CHIA

(Autographa
californica
multiple
nucleopolyhedrovirus) 		PF00704
(Glyco_hydro_18)
PF08329
(ChitinaseA_N) 		3 PHE A 377
SER A 175
LEU A 177
 None
 0.68A 2w1bA-5df0A:
undetectable		 2w1bA-5df0A:
20.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5dmy BETA-GALACTOSIDASE

(Bifidobacterium
bifidum) 		PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N)
PF16355
(DUF4982) 		3 PHE A 841
SER A 560
LEU A 558
 None
 0.50A 2w1bA-5dmyA:
undetectable		 2w1bA-5dmyA:
22.20
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.
5gtm INTERFERON-INDUCED
GTP-BINDING PROTEIN
MX1

(Homo sapiens) 		PF00350
(Dynamin_N)
PF01031
(Dynamin_M)
PF02212
(GED) 		3 PHE A 302
SER A 219
LEU A 251
 None
 0.62A 2w1bA-5gtmA:
2.5		 2w1bA-5gtmA:
21.46
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.
5gw7 GLUCOSIDASE YGJK

(Escherichia
coli) 		PF01204
(Trehalase) 		3 PHE A 348
SER A 398
LEU A 394
 None
 0.78A 2w1bA-5gw7A:
undetectable		 2w1bA-5gw7A:
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.
5nur ABC TRANSPORTER
PERMEASE

(Klebsiella
pneumoniae) 		no annotation 3 PHE D  29
SER D 191
LEU D 187
 None
 0.80A 2w1bA-5nurD:
undetectable		 2w1bA-5nurD:
12.11
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.
5tcv 1-AMINOCYCLOPROPANE-
1-CARBOXYLATE
OXIDASE 1

(Petunia x
hybrida) 		PF03171
(2OG-FeII_Oxy)
PF14226
(DIOX_N) 		3 PHE A   4
SER A 212
LEU A 186
 None
None
1AC  A 402 ( 3.8A)
 0.78A 2w1bA-5tcvA:
undetectable		 2w1bA-5tcvA:
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.
5u09 CANNABINOID RECEPTOR
1,GLGA GLYCOGEN
SYNTHASE

(Homo sapiens;
Pyrococcus
abyssi) 		PF00001
(7tm_1)
PF00534
(Glycos_transf_1) 		3 PHE A 102
SER A 383
LEU A 387
 None
7DY  A1210 (-3.0A)
7DY  A1210 (-4.6A)
 0.79A 2w1bA-5u09A:
undetectable		 2w1bA-5u09A:
19.61
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.
5u1s SEPARIN

(Saccharomyces
cerevisiae) 		PF03568
(Peptidase_C50) 		3 PHE A1584
SER A1477
LEU A1479
 None
 0.77A 2w1bA-5u1sA:
undetectable		 2w1bA-5u1sA:
21.06
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.
5uz5 U1 SMALL NUCLEAR
RIBONUCLEOPROTEIN
COMPONENT PRP42
PROTEIN NAM8

(Saccharomyces
cerevisiae;
Saccharomyces
cerevisiae) 		no annotation
no annotation 		3 PHE D 488
SER F 517
LEU F 513
 None
 0.81A 2w1bA-5uz5D:
undetectable		 2w1bA-5uz5D:
18.07
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.
5vha DEAH
(ASP-GLU-ALA-HIS)
BOX POLYPEPTIDE 36

(Bos taurus) 		no annotation 3 PHE A 883
SER A 875
LEU A 901
 None
 0.78A 2w1bA-5vhaA:
undetectable		 2w1bA-5vhaA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5vlj NUCLEAR DISTRIBUTION
PROTEIN PAC1

(Saccharomyces
cerevisiae) 		PF00400
(WD40) 		3 PHE B 182
SER B 149
LEU B 151
 None
 0.66A 2w1bA-5vljB:
undetectable		 2w1bA-5vljB:
15.94
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.
5xjn CYTOCHROME P450

(Corynebacterium
glutamicum) 		PF00067
(p450) 		3 PHE A 127
SER A 261
LEU A 259
 HEM  A 502 (-3.7A)
88L  A 501 ( 2.7A)
None
 0.63A 2w1bA-5xjnA:
2.7		 2w1bA-5xjnA:
18.38
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.
5zbh NEUROPEPTIDE Y
RECEPTOR TYPE 1,T4
LYSOZYME,NEUROPEPTID
E Y RECEPTOR TYPE 1

(Homo sapiens;
Escherichia
virus T4) 		no annotation 3 PHE A 327
SER A  83
LEU A  59
 None
 0.75A 2w1bA-5zbhA:
undetectable		 2w1bA-5zbhA:
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.
6d46 BETA SLIDING CLAMP

(Rickettsia
typhi) 		no annotation 3 PHE A 116
SER A  55
LEU A  45
 None
 0.75A 2w1bA-6d46A:
undetectable		 2w1bA-6d46A:
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.
6er3 BNR/ASP-BOX REPEAT
PROTEIN

([Ruminococcus]
gnavus) 		no annotation 3 PHE A 144
SER A 148
LEU A  37
 None
 0.77A 2w1bA-6er3A:
undetectable		 2w1bA-6er3A:
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.
6et0 PQSB

(Pseudomonas
aeruginosa) 		no annotation 3 PHE B 241
SER B 130
LEU B  64
 None
 0.59A 2w1bA-6et0B:
undetectable		 2w1bA-6et0B:
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.
6fay ODZ3 PROTEIN

(Mus musculus) 		no annotation 3 PHE A 983
SER A1692
LEU A1694
 None
 0.81A 2w1bA-6fayA:
undetectable		 2w1bA-6fayA:
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.
6fv5 QUEUINE
TRNA-RIBOSYLTRANSFER
ASE ACCESSORY
SUBUNIT 2

(Mus musculus) 		no annotation 3 PHE A 141
SER A 181
LEU A 177
 None
 0.53A 2w1bA-6fv5A:
undetectable		 2w1bA-6fv5A:
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.
6g1k TRANSIENT RECEPTOR
POTENTIAL CATION
CHANNEL SUBFAMILY C
MEMBER 4A

(Danio rerio) 		no annotation 3 PHE A 251
SER A 213
LEU A 211
 None
 0.83A 2w1bA-6g1kA:
undetectable		 2w1bA-6g1kA:
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.
6g2j NADH-UBIQUINONE
OXIDOREDUCTASE CHAIN
5

(Mus musculus) 		no annotation 3 PHE L  32
SER L  24
LEU L  20
 None
 0.78A 2w1bA-6g2jL:
undetectable		 2w1bA-6g2jL:
undetectable