SIMILAR PATTERNS OF AMINO ACIDS FOR 3CR5_X_PNTX95_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.
1cm0 P300/CBP ASSOCIATING
FACTOR

(Homo sapiens) 		no annotation 3 CYH B 574
PHE B 573
PHE B 522
 COA  B 700 (-3.1A)
None
None
 1.01A 3cr5X-1cm0B:
undetectable		 3cr5X-1cm0B:
20.24
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.
1lsh LIPOVITELLIN (LV-1N,
LV-1C)

(Ichthyomyzon
unicuspis) 		PF01347
(Vitellogenin_N)
PF09172
(DUF1943) 		3 CYH A 551
PHE A 554
PHE A 555
 None
 1.01A 3cr5X-1lshA:
undetectable		 3cr5X-1lshA:
6.27
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1mho S-100 PROTEIN

(Bos taurus) 		PF00036
(EF-hand_1)
PF01023
(S_100) 		3 CYH A  84
PHE A  87
PHE A  88
 None
 0.93A 3cr5X-1mhoA:
18.4		 3cr5X-1mhoA:
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.
1s5a HYPOTHETICAL PROTEIN
YESE

(Bacillus
subtilis) 		PF12680
(SnoaL_2) 		3 CYH A  93
PHE A  91
PHE A  73
 None
 0.79A 3cr5X-1s5aA:
undetectable		 3cr5X-1s5aA:
21.53
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.
1uag UDP-N-ACETYLMURAMOYL
-L-ALANINE/:D-GLUTAM
ATE LIGASE

(Escherichia
coli) 		PF02875
(Mur_ligase_C)
PF08245
(Mur_ligase_M) 		3 CYH A  20
PHE A  23
PHE A  24
 None
 0.47A 3cr5X-1uagA:
0.0		 3cr5X-1uagA:
12.36
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.
1uhg OVALBUMIN

(Gallus gallus) 		PF00079
(Serpin) 		3 CYH A  11
PHE A  15
PHE A  12
 None
 1.03A 3cr5X-1uhgA:
undetectable		 3cr5X-1uhgA:
12.57
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.
1xb7 STEROID HORMONE
RECEPTOR ERR1

(Homo sapiens) 		PF00104
(Hormone_recep) 		3 CYH A 325
PHE A 328
PHE A 510
 None
 1.04A 3cr5X-1xb7A:
0.0		 3cr5X-1xb7A:
15.64
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.
1xbf CLOSTRIDIUM
ACETOBUTYLICUM
Q97KL0

(Clostridium
acetobutylicum) 		PF01894
(UPF0047) 		3 CYH A  42
PHE A 128
PHE A  41
 None
 0.99A 3cr5X-1xbfA:
undetectable		 3cr5X-1xbfA:
19.44
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.
1y8c S-ADENOSYLMETHIONINE
-DEPENDENT
METHYLTRANSFERASE

(Clostridium
acetobutylicum) 		PF13649
(Methyltransf_25) 		3 CYH A 108
PHE A 141
PHE A 139
 None
 0.75A 3cr5X-1y8cA:
undetectable		 3cr5X-1y8cA:
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.
1z01 2-OXO-1,2-DIHYDROQUI
NOLINE
8-MONOOXYGENASE,
OXYGENASE COMPONENT

(Pseudomonas
putida) 		PF00355
(Rieske)
PF11723
(Aromatic_hydrox) 		3 CYH A 105
PHE A 110
PHE A 112
 FES  A 500 (-2.3A)
FES  A 500 (-4.1A)
None
 1.00A 3cr5X-1z01A:
undetectable		 3cr5X-1z01A:
11.88
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.
1z6m CONSERVED
HYPOTHETICAL PROTEIN

(Enterococcus
faecalis) 		PF13462
(Thioredoxin_4) 		3 CYH A  39
PHE A  43
PHE A  99
 None
 0.81A 3cr5X-1z6mA:
undetectable		 3cr5X-1z6mA:
23.08
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.
2ajr SUGAR KINASE, PFKB
FAMILY

(Thermotoga
maritima) 		PF00294
(PfkB) 		3 CYH A 137
PHE A 166
PHE A 168
 None
 1.03A 3cr5X-2ajrA:
undetectable		 3cr5X-2ajrA:
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.
2b5n DAMAGE-SPECIFIC DNA
BINDING PROTEIN 1

(Homo sapiens) 		PF10433
(MMS1_N) 		3 CYH A 604
PHE A 612
PHE A 614
 None
 0.96A 3cr5X-2b5nA:
undetectable		 3cr5X-2b5nA:
12.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2bkr SENTRIN-SPECIFIC
PROTEASE 8

(Homo sapiens) 		PF02902
(Peptidase_C48) 		3 CYH A 175
PHE A 178
PHE A 179
 None
 1.07A 3cr5X-2bkrA:
0.4		 3cr5X-2bkrA:
16.92
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.
2bkw ALANINE-GLYOXYLATE
AMINOTRANSFERASE 1

(Saccharomyces
cerevisiae) 		PF00266
(Aminotran_5) 		3 CYH A 373
PHE A 374
PHE A 293
 None
 1.05A 3cr5X-2bkwA:
undetectable		 3cr5X-2bkwA:
13.12
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.
2gmg HYPOTHETICAL PROTEIN
PF0610

(Pyrococcus
furiosus) 		no annotation 3 CYH A  70
PHE A  75
PHE A  77
 None
 0.71A 3cr5X-2gmgA:
undetectable		 3cr5X-2gmgA:
20.56
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.
2gzk SEX-DETERMINING
REGION ON Y / HMGB1

(Homo sapiens;
Rattus rattus) 		PF00505
(HMG_box) 		3 CYH A 100
PHE A  97
PHE A  96
 None
 0.89A 3cr5X-2gzkA:
0.0		 3cr5X-2gzkA:
18.92
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.
2h1r DIMETHYLADENOSINE
TRANSFERASE,
PUTATIVE

(Plasmodium
falciparum) 		PF00398
(RrnaAD) 		3 CYH A  89
PHE A 112
PHE A  86
 None
 1.04A 3cr5X-2h1rA:
0.0		 3cr5X-2h1rA:
12.33
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2jpt PROTEIN S100-A1

(Bos taurus) 		PF00036
(EF-hand_1)
PF01023
(S_100) 		3 CYH A  85
PHE A  88
PHE A  89
 BME  A  94 (-2.0A)
None
BME  A  94 ( 4.9A)
 0.81A 3cr5X-2jptA:
4.8		 3cr5X-2jptA:
58.06
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.
2jr5 UPF0350 PROTEIN
VC_2471

(Vibrio cholerae) 		PF03937
(Sdh5) 		3 CYH A  32
PHE A  33
PHE A  29
 None
 0.99A 3cr5X-2jr5A:
undetectable		 3cr5X-2jr5A:
26.42
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.
2kjd SODIUM/HYDROGEN
EXCHANGE REGULATORY
COFACTOR NHE-RF1

(Homo sapiens) 		PF00595
(PDZ)
PF09007
(EBP50_C) 		3 CYH A 100
PHE A  97
PHE A  96
 None
 0.77A 3cr5X-2kjdA:
undetectable		 3cr5X-2kjdA:
20.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qmx PREPHENATE
DEHYDRATASE

(Chlorobaculum
tepidum) 		PF00800
(PDT) 		3 CYH A 109
PHE A 112
PHE A 113
 None
 0.77A 3cr5X-2qmxA:
undetectable		 3cr5X-2qmxA:
13.52
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.
2rv1 ZINC FINGER PROTEIN
ZFAT

(Homo sapiens) 		no annotation 3 CYH A  12
PHE A  17
PHE A  19
 ZN  A 101 (-2.1A)
None
None
 1.07A 3cr5X-2rv1A:
undetectable		 3cr5X-2rv1A:
19.64
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.
2v8n LACTOSE PERMEASE

(Escherichia
coli) 		PF01306
(LacY_symp) 		3 CYH A 148
PHE A  16
PHE A  20
 None
 0.94A 3cr5X-2v8nA:
0.0		 3cr5X-2v8nA:
9.11
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.
2vfv XYLITOL OXIDASE

(Streptomyces
coelicolor) 		PF01565
(FAD_binding_4)
PF04030
(ALO) 		3 CYH A 258
PHE A 279
PHE A 275
 None
 1.07A 3cr5X-2vfvA:
undetectable		 3cr5X-2vfvA:
15.19
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.
2wsx L-CARNITINE/GAMMA-BU
TYROBETAINE
ANTIPORTER

(Escherichia
coli) 		PF02028
(BCCT) 		3 CYH A 481
PHE A 484
PHE A 485
 None
 0.80A 3cr5X-2wsxA:
0.8		 3cr5X-2wsxA:
9.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2wtb FATTY ACID
MULTIFUNCTIONAL
PROTEIN (ATMFP2)

(Arabidopsis
thaliana) 		PF00378
(ECH_1)
PF00725
(3HCDH)
PF02737
(3HCDH_N) 		3 CYH A 640
PHE A 643
PHE A 703
 None
 0.88A 3cr5X-2wtbA:
undetectable		 3cr5X-2wtbA:
7.54
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.
2xhy 6-PHOSPHO-BETA-GLUCO
SIDASE BGLA

(Escherichia
coli) 		PF00232
(Glyco_hydro_1) 		3 CYH A  87
PHE A  88
PHE A  85
 None
 0.86A 3cr5X-2xhyA:
undetectable		 3cr5X-2xhyA:
11.36
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.
2xsw 72 KDA INOSITOL
POLYPHOSPHATE
5-PHOSPHATASE

(Homo sapiens) 		PF03372
(Exo_endo_phos) 		3 CYH A 385
PHE A 384
PHE A 413
 None
 0.95A 3cr5X-2xswA:
undetectable		 3cr5X-2xswA:
12.32
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2y5i S100 CALCIUM BINDING
PROTEIN Z

(Danio rerio) 		PF01023
(S_100) 		3 CYH A  86
PHE A  89
PHE A  90
 None
 0.34A 3cr5X-2y5iA:
14.9		 3cr5X-2y5iA:
55.32
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.
3axi OLIGO-1,6-GLUCOSIDAS
E IMA1

(Saccharomyces
cerevisiae) 		PF00128
(Alpha-amylase) 		3 CYH A 179
PHE A 178
PHE A 159
 None
GLC  A 601 (-3.4A)
GLC  A 601 (-4.6A)
 0.74A 3cr5X-3axiA:
undetectable		 3cr5X-3axiA:
9.68
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.
3ayt PUTATIVE
UNCHARACTERIZED
PROTEIN TTHB071

(Thermus
thermophilus) 		PF01261
(AP_endonuc_2) 		3 CYH A 160
PHE A 161
PHE A 159
 None
 1.08A 3cr5X-3aytA:
undetectable		 3cr5X-3aytA:
14.62
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.
3ebb PHOSPHOLIPASE
A2-ACTIVATING
PROTEIN

(Homo sapiens) 		PF08324
(PUL) 		3 CYH A 631
PHE A 630
PHE A 639
 None
 0.83A 3cr5X-3ebbA:
undetectable		 3cr5X-3ebbA:
13.82
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.
3flt SAP-LIKE PENTRAXIN

(Limulus
polyphemus) 		PF00354
(Pentaxin) 		3 CYH A  53
PHE A  62
PHE A  51
 None
 0.74A 3cr5X-3fltA:
undetectable		 3cr5X-3fltA:
14.36
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.
3frw PUTATIVE TRP
REPRESSOR PROTEIN

(Blautia obeum) 		PF01371
(Trp_repressor) 		3 CYH A  26
PHE A  29
PHE A  30
 None
 0.71A 3cr5X-3frwA:
undetectable		 3cr5X-3frwA:
23.28
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.
3g23 LD-CARBOXYPEPTIDASE
A

(Novosphingobium
aromaticivorans) 		PF02016
(Peptidase_S66) 		3 CYH A  41
PHE A  14
PHE A  42
 None
 0.87A 3cr5X-3g23A:
undetectable		 3cr5X-3g23A:
15.38
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.
3ggd SAM-DEPENDENT
METHYLTRANSFERASE

(Trichormus
variabilis) 		PF13649
(Methyltransf_25) 		3 CYH A 167
PHE A 170
PHE A 171
 None
 0.97A 3cr5X-3ggdA:
undetectable		 3cr5X-3ggdA:
15.81
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.
3h0g DNA-DIRECTED RNA
POLYMERASE II
SUBUNIT RPB1

(Schizosaccharomyces
pombe) 		PF00623
(RNA_pol_Rpb1_2)
PF04983
(RNA_pol_Rpb1_3)
PF04990
(RNA_pol_Rpb1_7)
PF04992
(RNA_pol_Rpb1_6)
PF04997
(RNA_pol_Rpb1_1)
PF04998
(RNA_pol_Rpb1_5)
PF05000
(RNA_pol_Rpb1_4) 		3 CYH A 648
PHE A 651
PHE A 652
 None
 0.67A 3cr5X-3h0gA:
undetectable		 3cr5X-3h0gA:
5.24
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.
3hgq HDA1 COMPLEX SUBUNIT
3

(Saccharomyces
cerevisiae) 		PF11496
(HDA2-3) 		3 CYH A 247
PHE A 250
PHE A 251
 None
 0.81A 3cr5X-3hgqA:
undetectable		 3cr5X-3hgqA:
15.68
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.
3jb9 PRE-MRNA-SPLICING
FACTOR CWF10

(Schizosaccharomyces
pombe) 		PF00009
(GTP_EFTU)
PF00679
(EFG_C)
PF03144
(GTP_EFTU_D2)
PF03764
(EFG_IV)
PF16004
(EFTUD2) 		3 CYH B 432
PHE B 435
PHE B 436
 None
 0.56A 3cr5X-3jb9B:
undetectable		 3cr5X-3jb9B:
6.73
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.
3khy PROPIONATE KINASE

(Francisella
tularensis) 		PF00871
(Acetate_kinase) 		3 CYH A 128
PHE A 127
PHE A  63
 None
 1.03A 3cr5X-3khyA:
undetectable		 3cr5X-3khyA:
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.
3knb OBSCURIN-LIKE
PROTEIN 1

(Homo sapiens) 		PF07679
(I-set) 		3 CYH B  35
PHE B  19
PHE B  16
 None
 0.82A 3cr5X-3knbB:
undetectable		 3cr5X-3knbB:
18.92
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.
3kor POSSIBLE TRP
REPRESSOR

(Staphylococcus
aureus) 		PF01371
(Trp_repressor) 		3 CYH A  27
PHE A  30
PHE A  31
 None
 0.56A 3cr5X-3korA:
undetectable		 3cr5X-3korA:
20.33
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.
3m1i RAN-SPECIFIC
GTPASE-ACTIVATING
PROTEIN 1

(Saccharomyces
cerevisiae) 		PF00638
(Ran_BP1) 		3 CYH B 160
PHE B 172
PHE B 174
 None
 0.78A 3cr5X-3m1iB:
undetectable		 3cr5X-3m1iB:
21.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3mi9 PROTEIN TAT

(Human
immunodeficiency
virus 1) 		PF00539
(Tat) 		3 CYH C  31
PHE C  38
PHE C  32
 None
 0.66A 3cr5X-3mi9C:
undetectable		 3cr5X-3mi9C:
11.96
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.
3n0g ISOPRENE SYNTHASE

(Populus tremula
x Populus alba) 		PF01397
(Terpene_synth)
PF03936
(Terpene_synth_C) 		3 CYH A 382
PHE A 383
PHE A 360
 None
 1.09A 3cr5X-3n0gA:
undetectable		 3cr5X-3n0gA:
10.82
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.
3naw SECRETED EFFECTOR
PROTEIN

(Escherichia
coli) 		PF00805
(Pentapeptide)
PF13979
(SopA_C)
PF13981
(SopA) 		3 CYH A 429
PHE A 432
PHE A 433
 None
 0.57A 3cr5X-3nawA:
undetectable		 3cr5X-3nawA:
10.02
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.
3on5 BH1974 PROTEIN

(Bacillus
halodurans) 		PF02625
(XdhC_CoxI)
PF13478
(XdhC_C) 		3 CYH A 216
PHE A 220
PHE A 221
 None
 1.02A 3cr5X-3on5A:
undetectable		 3cr5X-3on5A:
13.69
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.
3ono RIBOSE/GALACTOSE
ISOMERASE

(Vibrio
parahaemolyticus) 		PF02502
(LacAB_rpiB)
PF12408
(DUF3666) 		3 CYH A 192
PHE A 193
PHE A 189
 None
 0.82A 3cr5X-3onoA:
undetectable		 3cr5X-3onoA:
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.
3qak ADENOSINE RECEPTOR
A2A,LYSOZYME CHIMERA

(Homo sapiens;
Escherichia
virus T4) 		PF00001
(7tm_1)
PF00959
(Phage_lysozyme) 		3 CYH A 254
PHE A 257
PHE A 258
 None
 0.58A 3cr5X-3qakA:
undetectable		 3cr5X-3qakA:
11.04
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.
3qnk PUTATIVE LIPOPROTEIN

(Bacteroides
fragilis) 		PF07980
(SusD_RagB)
PF14322
(SusD-like_3) 		3 CYH A 111
PHE A 114
PHE A 115
 None
 0.39A 3cr5X-3qnkA:
undetectable		 3cr5X-3qnkA:
12.29
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.
3qom 6-PHOSPHO-BETA-GLUCO
SIDASE

(Lactobacillus
plantarum) 		PF00232
(Glyco_hydro_1) 		3 CYH A  87
PHE A  88
PHE A  85
 None
 1.04A 3cr5X-3qomA:
undetectable		 3cr5X-3qomA:
11.92
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.
3rsc CALG2

(Micromonospora
echinospora) 		PF04101
(Glyco_tran_28_C) 		3 CYH A 249
PHE A 246
PHE A 245
 None
 0.80A 3cr5X-3rscA:
undetectable		 3cr5X-3rscA:
11.49
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.
3tw8 DENN
DOMAIN-CONTAINING
PROTEIN 1B

(Homo sapiens) 		PF02141
(DENN)
PF03455
(dDENN)
PF03456
(uDENN) 		3 CYH A  53
PHE A  52
PHE A  72
 None
 0.88A 3cr5X-3tw8A:
undetectable		 3cr5X-3tw8A:
14.03
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.
3v9f TWO-COMPONENT SYSTEM
SENSOR HISTIDINE
KINASE/RESPONSE
REGULATOR, HYBRID
(ONE-COMPONENT
SYSTEM)

(Bacteroides
thetaiotaomicron) 		PF07494
(Reg_prop)
PF07495
(Y_Y_Y) 		3 CYH A 667
PHE A 660
PHE A 645
 None
 0.95A 3cr5X-3v9fA:
undetectable		 3cr5X-3v9fA:
8.87
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.
3x1d ATLASTIN

(Drosophila
melanogaster) 		PF02263
(GBP) 		3 CYH A 235
PHE A 184
PHE A 236
 None
 0.76A 3cr5X-3x1dA:
undetectable		 3cr5X-3x1dA:
11.84
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.
3zjc GTPASE IMAP FAMILY
MEMBER 7

(Homo sapiens) 		PF04548
(AIG1) 		3 CYH A 165
PHE A 131
PHE A 142
 None
 1.09A 3cr5X-3zjcA:
undetectable		 3cr5X-3zjcA:
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.
3zyv AOX3

(Mus musculus) 		PF00111
(Fer2)
PF00941
(FAD_binding_5)
PF01315
(Ald_Xan_dh_C)
PF01799
(Fer2_2)
PF02738
(Ald_Xan_dh_C2)
PF03450
(CO_deh_flav_C) 		3 CYH A1273
PHE A1276
PHE A1277
 None
 0.90A 3cr5X-3zyvA:
undetectable		 3cr5X-3zyvA:
5.67
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.
4a1g MITOTIC CHECKPOINT
SERINE/THREONINE-PRO
TEIN KINASE BUB1

(Homo sapiens) 		PF08311
(Mad3_BUB1_I) 		3 CYH A  72
PHE A  75
PHE A  85
 None
 0.96A 3cr5X-4a1gA:
undetectable		 3cr5X-4a1gA:
19.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4a3t DNA MISMATCH REPAIR
PROTEIN HSM3

(Saccharomyces
cerevisiae) 		no annotation 3 CYH A 218
PHE A 217
PHE A 244
 None
 1.01A 3cr5X-4a3tA:
undetectable		 3cr5X-4a3tA:
10.77
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.
4c0d CCR4-NOT
TRANSCRIPTION
COMPLEX SUBUNIT 1

(Homo sapiens) 		PF04054
(Not1) 		3 CYH A2020
PHE A2019
PHE A2023
 None
 0.98A 3cr5X-4c0dA:
undetectable		 3cr5X-4c0dA:
8.64
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.
4dal PUTATIVE ALDEHYDE
DEHYDROGENASE

(Sinorhizobium
meliloti) 		PF00171
(Aldedh) 		3 CYH A 107
PHE A 110
PHE A 111
 None
 0.90A 3cr5X-4dalA:
undetectable		 3cr5X-4dalA:
11.04
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.
4dkw LARGE TERMINASE
PROTEIN

(Salmonella
virus P22) 		PF17289
(Terminase_6C) 		3 CYH A 435
PHE A 438
PHE A 439
 None
 0.71A 3cr5X-4dkwA:
undetectable		 3cr5X-4dkwA:
15.24
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.
4es4 PUTATIVE CYCLIC
DI-GMP REGULATOR
CDGR

(Escherichia
coli) 		PF00563
(EAL) 		3 CYH A  71
PHE A  74
PHE A  75
 None
 0.65A 3cr5X-4es4A:
undetectable		 3cr5X-4es4A:
17.30
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.
4fah GENTISATE
1,2-DIOXYGENASE

(Pseudaminobacter
salicylatoxidans) 		PF07883
(Cupin_2) 		3 CYH A 281
PHE A 348
PHE A 346
 None
 0.83A 3cr5X-4fahA:
undetectable		 3cr5X-4fahA:
11.44
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.
4gbr BETA-2 ADRENERGIC
RECEPTOR

(Homo sapiens) 		PF00001
(7tm_1) 		3 CYH A 299
PHE A 304
PHE A 308
 None
 1.07A 3cr5X-4gbrA:
undetectable		 3cr5X-4gbrA:
14.24
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.
4hav RAN-SPECIFIC
GTPASE-ACTIVATING
PROTEIN 1

(Saccharomyces
cerevisiae) 		PF00638
(Ran_BP1) 		3 CYH B 160
PHE B 172
PHE B 174
 None
 0.84A 3cr5X-4havB:
undetectable		 3cr5X-4havB:
23.70
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.
4hb4 EXPORTIN-1

(Saccharomyces
cerevisiae) 		PF03810
(IBN_N)
PF08389
(Xpo1)
PF08767
(CRM1_C) 		3 CYH C 197
PHE C 198
PHE C 194
 None
 0.80A 3cr5X-4hb4C:
0.8		 3cr5X-4hb4C:
7.32
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.
4i6v AMIDOHYDROLASE 2

(Planctopirus
limnophila) 		PF02614
(UxaC) 		3 CYH A  95
PHE A  98
PHE A  99
 None
 1.08A 3cr5X-4i6vA:
undetectable		 3cr5X-4i6vA:
12.25
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.
4j05 PHOSPHATE
TRANSPORTER

(Serendipita
indica) 		PF00083
(Sugar_tr) 		3 CYH A 418
PHE A 421
PHE A 399
 None
 1.00A 3cr5X-4j05A:
undetectable		 3cr5X-4j05A:
10.70
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.
4j9u TRK SYSTEM POTASSIUM
UPTAKE PROTEIN TRKH

(Vibrio
parahaemolyticus) 		PF02386
(TrkH) 		3 CYH A 290
PHE A 291
PHE A 287
 None
 1.07A 3cr5X-4j9uA:
0.3		 3cr5X-4j9uA:
9.80
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.
4m9x CELL DEATH PROTEIN 4

(Caenorhabditis
elegans) 		PF00619
(CARD)
PF00931
(NB-ARC) 		3 CYH A 268
PHE A 247
PHE A 249
 None
 1.02A 3cr5X-4m9xA:
undetectable		 3cr5X-4m9xA:
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.
4ogr PROTEIN TAT

(Human
immunodeficiency
virus 1) 		PF00539
(Tat) 		3 CYH D  31
PHE D  38
PHE D  32
 None
 0.76A 3cr5X-4ogrD:
undetectable		 3cr5X-4ogrD:
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.
4or5 PROTEIN TAT

(Human
immunodeficiency
virus 1) 		PF00539
(Tat) 		3 CYH C  31
PHE C  38
PHE C  32
 None
 0.59A 3cr5X-4or5C:
undetectable		 3cr5X-4or5C:
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.
4pir 5-HYDROXYTRYPTAMINE
RECEPTOR 3A

(Mus musculus) 		PF02931
(Neur_chan_LBD)
PF02932
(Neur_chan_memb) 		3 CYH A 243
PHE A 242
PHE A 438
 None
 0.77A 3cr5X-4pirA:
undetectable		 3cr5X-4pirA:
10.99
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.
4q6r SPHINGOSINE-1-PHOSPH
ATE LYASE 1

(Homo sapiens) 		PF00282
(Pyridoxal_deC) 		3 CYH A 193
PHE A 196
PHE A 339
 None
 0.82A 3cr5X-4q6rA:
undetectable		 3cr5X-4q6rA:
14.63
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.
4qc8 VP2

(Ungulate
bocaparvovirus
1) 		PF00740
(Parvo_coat) 		3 CYH A 163
PHE A 452
PHE A 162
 None
 0.93A 3cr5X-4qc8A:
undetectable		 3cr5X-4qc8A:
9.90
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.
4ryk LMO0325 PROTEIN

(Listeria
monocytogenes) 		PF01381
(HTH_3) 		3 CYH A 198
PHE A 197
PHE A 201
 None
 0.97A 3cr5X-4rykA:
undetectable		 3cr5X-4rykA:
15.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4trk C. ELEGANS HIM-3

(Caenorhabditis
elegans) 		PF02301
(HORMA) 		3 CYH A  61
PHE A  75
PHE A  62
 None
 0.80A 3cr5X-4trkA:
undetectable		 3cr5X-4trkA:
13.70
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.
5b04 PROBABLE TRANSLATION
INITIATION FACTOR
EIF-2B SUBUNIT GAMMA

(Schizosaccharomyces
pombe) 		PF00483
(NTP_transferase) 		3 CYH E 145
PHE E 243
PHE E 245
 None
 0.89A 3cr5X-5b04E:
undetectable		 3cr5X-5b04E:
11.86
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.
5bza BETA-N-ACETYLHEXOSAM
INIDASE

(Thermotoga
neapolitana) 		PF00933
(Glyco_hydro_3) 		3 CYH A  11
PHE A 278
PHE A  13
 None
 0.96A 3cr5X-5bzaA:
undetectable		 3cr5X-5bzaA:
11.47
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.
5djq CBB3-TYPE CYTOCHROME
C OXIDASE SUBUNIT
CCON1

(Pseudomonas
stutzeri) 		PF00115
(COX1) 		3 CYH A  71
PHE A  74
PHE A  17
 None
 1.02A 3cr5X-5djqA:
undetectable		 3cr5X-5djqA:
10.26
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.
5dl2 REGULATOR OF
PROTEASE B (ROPB)

(Streptococcus
pyogenes) 		no annotation 3 CYH A 228
PHE A 231
PHE A 232
 None
 0.52A 3cr5X-5dl2A:
undetectable		 3cr5X-5dl2A:
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.
5epg ALDEHYDE OXIDASE

(Homo sapiens) 		PF00111
(Fer2)
PF00941
(FAD_binding_5)
PF01315
(Ald_Xan_dh_C)
PF01799
(Fer2_2)
PF02738
(Ald_Xan_dh_C2)
PF03450
(CO_deh_flav_C) 		3 CYH A1277
PHE A1280
PHE A1281
 None
 0.82A 3cr5X-5epgA:
undetectable		 3cr5X-5epgA:
5.50
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.
5fu7 CCR4-NOT
TRANSCRIPTION
COMPLEX SUBUNIT 1

(Homo sapiens) 		PF04054
(Not1) 		3 CYH A2020
PHE A2019
PHE A2023
 None
 1.05A 3cr5X-5fu7A:
0.9		 3cr5X-5fu7A:
12.38
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.
5g53 ADENOSINE RECEPTOR
A2A

(Homo sapiens) 		PF00001
(7tm_1) 		3 CYH A 254
PHE A 257
PHE A 258
 None
 0.63A 3cr5X-5g53A:
undetectable		 3cr5X-5g53A:
14.56
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.
5hzg F-BOX/LRR-REPEAT
MAX2 HOMOLOG

(Oryza sativa) 		no annotation 3 CYH B 142
PHE B  79
PHE B 143
 None
 0.81A 3cr5X-5hzgB:
undetectable		 3cr5X-5hzgB:
7.14
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.
5i68 ALCOHOL OXIDASE 1

(Komagataella
pastoris) 		PF00732
(GMC_oxred_N)
PF05199
(GMC_oxred_C) 		3 CYH A 311
PHE A 419
PHE A 417
 None
 0.66A 3cr5X-5i68A:
undetectable		 3cr5X-5i68A:
7.16
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.
5ols RHAMNOGALACTURONAN
LYASE

(Bacteroides
thetaiotaomicron) 		no annotation 3 CYH A 158
PHE A 129
PHE A 159
 None
 0.82A 3cr5X-5olsA:
undetectable		 3cr5X-5olsA:
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.
5td8 KINETOCHORE PROTEIN
NUF2

(Saccharomyces
cerevisiae) 		PF03800
(Nuf2) 		3 CYH B  94
PHE B  97
PHE B  98
 HG  B 502 (-3.0A)
HG  B 502 (-4.0A)
HG  B 502 (-4.6A)
 0.52A 3cr5X-5td8B:
2.7		 3cr5X-5td8B:
21.05
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.
5uv2 (+)-LIMONENE
SYNTHASE

(Citrus sinensis) 		PF01397
(Terpene_synth)
PF03936
(Terpene_synth_C) 		3 CYH A 381
PHE A 382
PHE A 358
 None
 1.07A 3cr5X-5uv2A:
undetectable		 3cr5X-5uv2A:
9.71
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.
5vha DEAH
(ASP-GLU-ALA-HIS)
BOX POLYPEPTIDE 36

(Bos taurus) 		no annotation 3 CYH A 911
PHE A 914
PHE A 915
 None
 0.91A 3cr5X-5vhaA:
2.4		 3cr5X-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.
5w25 ASPARTATE--TRNA(ASP/
ASN) LIGASE

(Mycobacterium
tuberculosis) 		PF00152
(tRNA-synt_2)
PF01336
(tRNA_anti-codon)
PF02938
(GAD) 		3 CYH A 297
PHE A 300
PHE A 301
 None
 0.51A 3cr5X-5w25A:
undetectable		 3cr5X-5w25A:
10.20
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.
5y3r DNA-DEPENDENT
PROTEIN KINASE
CATALYTIC SUBUNIT

(Homo sapiens) 		PF00454
(PI3_PI4_kinase)
PF02259
(FAT)
PF02260
(FATC)
PF08163
(NUC194) 		3 CYH C 703
PHE C 707
PHE C 704
 None
 0.90A 3cr5X-5y3rC:
undetectable		 3cr5X-5y3rC:
2.00
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.
6aqf ADENOSINE RECEPTOR
A2A,SOLUBLE
CYTOCHROME
B562,ADENOSINE
RECEPTOR A2A

(Escherichia
coli;
Homo sapiens) 		no annotation 3 CYH A 254
PHE A 257
PHE A 258
 CLR  A1203 (-4.0A)
None
None
 0.69A 3cr5X-6aqfA:
undetectable		 3cr5X-6aqfA:
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.
6c26 DOLICHYL-DIPHOSPHOOL
IGOSACCHARIDE--PROTE
IN
GLYCOSYLTRANSFERASE
SUBUNIT STT3

(Saccharomyces
cerevisiae) 		no annotation 3 CYH A 196
PHE A 200
PHE A 181
 EGY  1 502 ( 3.7A)
None
None
 0.81A 3cr5X-6c26A:
undetectable		 3cr5X-6c26A:
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.
6c90 EXOSOME RNA HELICASE
MTR4,EXOSOME RNA
HELICASE MTR4

(Homo sapiens) 		no annotation 3 CYH A 911
PHE A 962
PHE A 912
 None
 0.89A 3cr5X-6c90A:
undetectable		 3cr5X-6c90A:
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.
6c93 CYTOCHROME P450 4B1

(Oryctolagus
cuniculus) 		no annotation 3 CYH A 465
PHE A 469
PHE A 471
 None
 1.07A 3cr5X-6c93A:
undetectable		 3cr5X-6c93A:
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.
6d6q EXOSOME RNA HELICASE
MTR4

(Homo sapiens) 		no annotation 3 CYH M 911
PHE M 962
PHE M 912
 None
 1.04A 3cr5X-6d6qM:
undetectable		 3cr5X-6d6qM:
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.
6fls -

(-) 		no annotation 3 CYH A  65
PHE A  45
PHE A  47
 None
 1.03A 3cr5X-6flsA:
undetectable		 3cr5X-6flsA:
undetectable