SIMILAR PATTERNS OF AMINO ACIDS FOR 4A9K_A_TYLA2200

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.
1fps FARNESYL DIPHOSPHATE
SYNTHASE

(Gallus gallus) 		PF00348
(polyprenyl_synt) 		4 VAL A 138
TYR A  65
ASN A  66
VAL A 115
 None
 0.91A 4a9kA-1fpsA:
0.0		 4a9kA-1fpsA:
17.75
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.
1hc7 PROLYL-TRNA
SYNTHETASE

(Thermus
thermophilus) 		PF00587
(tRNA-synt_2b)
PF03129
(HGTP_anticodon)
PF09180
(ProRS-C_1) 		4 VAL A 417
ILE A 436
TYR A 410
VAL A 407
 None
 0.93A 4a9kA-1hc7A:
undetectable		 4a9kA-1hc7A:
13.00
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.
1kj9 PHOSPHORIBOSYLGLYCIN
AMIDE
FORMYLTRANSFERASE 2

(Escherichia
coli) 		PF02222
(ATP-grasp) 		4 VAL A  36
LEU A   4
TYR A  78
VAL A 304
 None
 0.89A 4a9kA-1kj9A:
0.0		 4a9kA-1kj9A:
13.60
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.
1o66 3-METHYL-2-OXOBUTANO
ATE
HYDROXYMETHYLTRANSFE
RASE

(Neisseria
meningitidis) 		PF02548
(Pantoate_transf) 		4 VAL A 175
LEU A   7
ILE A  17
VAL A  80
 None
 0.80A 4a9kA-1o66A:
undetectable		 4a9kA-1o66A:
17.65
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.
1qox BETA-GLUCOSIDASE

(Bacillus
circulans) 		PF00232
(Glyco_hydro_1) 		4 LEU A 124
ILE A  34
ASN A 175
VAL A 193
 None
 0.93A 4a9kA-1qoxA:
undetectable		 4a9kA-1qoxA:
13.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1t3q QUINOLINE
2-OXIDOREDUCTASE
MEDIUM SUBUNIT

(Pseudomonas
putida) 		PF00941
(FAD_binding_5)
PF03450
(CO_deh_flav_C) 		4 VAL C  86
LEU C  69
ILE C 171
VAL C  75
 None
 0.83A 4a9kA-1t3qC:
0.0		 4a9kA-1t3qC:
17.67
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.
1tr1 BETA-GLUCOSIDASE A

(Paenibacillus
polymyxa) 		PF00232
(Glyco_hydro_1) 		4 LEU A 124
ILE A  34
ASN A 175
VAL A 193
 None
 0.89A 4a9kA-1tr1A:
undetectable		 4a9kA-1tr1A:
13.35
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.
1u2m HISTONE-LIKE PROTEIN
HLP-1

(Escherichia
coli) 		PF03938
(OmpH) 		4 VAL A  27
LEU A  32
ILE A 120
VAL A 127
 None
 0.93A 4a9kA-1u2mA:
0.2		 4a9kA-1u2mA:
24.03
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.
2adc POLYPYRIMIDINE
TRACT-BINDING
PROTEIN 1

(Homo sapiens) 		PF00076
(RRM_1)
PF13893
(RRM_5) 		4 VAL A 349
LEU A 344
ILE A 404
VAL A 367
 None
 0.94A 4a9kA-2adcA:
0.0		 4a9kA-2adcA:
21.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2dis UNNAMED PROTEIN
PRODUCT

(Homo sapiens) 		PF00076
(RRM_1) 		4 VAL A  32
LEU A  79
ILE A  84
VAL A  57
 None
 0.95A 4a9kA-2disA:
undetectable		 4a9kA-2disA:
20.30
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.
2dt8 DEGV FAMILY PROTEIN

(Thermus
thermophilus) 		PF02645
(DegV) 		4 VAL A 142
LEU A 139
ILE A   3
VAL A 113
 None
 0.95A 4a9kA-2dt8A:
0.0		 4a9kA-2dt8A:
18.22
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2dvr BROMODOMAIN-CONTAINI
NG PROTEIN 2

(Homo sapiens) 		PF00439
(Bromodomain) 		4 VAL A  37
LEU A  42
TYR A  89
ASN A  90
 None
 0.55A 4a9kA-2dvrA:
17.8		 4a9kA-2dvrA:
34.11
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.
2g1s RENIN

(Homo sapiens) 		PF00026
(Asp) 		4 VAL A  94
LEU A 173
ILE A 142
VAL A 123
 None
 0.93A 4a9kA-2g1sA:
undetectable		 4a9kA-2g1sA:
14.50
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.
2go2 KUNITZ-TYPE SERINE
PROTEASE INHIBITOR
BBKI

(Bauhinia
bauhinioides) 		PF00197
(Kunitz_legume) 		4 VAL A 114
LEU A  74
ILE A  76
VAL A  12
 None
 0.87A 4a9kA-2go2A:
undetectable		 4a9kA-2go2A:
21.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2h6o MAJOR OUTER ENVELOPE
GLYCOPROTEIN GP350

(Human
gammaherpesvirus
4) 		PF05109
(Herpes_BLLF1) 		4 VAL A 181
LEU A 179
ILE A 303
VAL A 283
 None
 0.90A 4a9kA-2h6oA:
undetectable		 4a9kA-2h6oA:
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.
2ij9 URIDYLATE KINASE

(Archaeoglobus
fulgidus) 		PF00696
(AA_kinase) 		4 VAL A 141
LEU A 158
ILE A 218
VAL A 167
 None
 0.88A 4a9kA-2ij9A:
0.0		 4a9kA-2ij9A:
20.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2j42 C2 TOXIN
COMPONENT-II

(Clostridium
botulinum) 		PF03495
(Binary_toxB)
PF07691
(PA14)
PF17475
(Binary_toxB_2)
PF17476
(Binary_toxB_3) 		4 LEU A  46
ILE A 135
ASN A  98
VAL A  90
 None
 0.81A 4a9kA-2j42A:
undetectable		 4a9kA-2j42A:
10.07
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.
2kd2 FAS APOPTOTIC
INHIBITORY MOLECULE
1

(Mus musculus) 		PF06905
(FAIM1) 		4 VAL A 111
LEU A 167
ILE A 174
VAL A 144
 None
 0.92A 4a9kA-2kd2A:
undetectable		 4a9kA-2kd2A:
23.53
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.
2lb5 SENSOR HISTIDINE
KINASE

(Synechococcus
sp.
JA-2-3B'a(2-13)) 		PF01590
(GAF) 		4 VAL A  53
LEU A 156
ILE A 195
VAL A  42
 None
 0.91A 4a9kA-2lb5A:
0.0		 4a9kA-2lb5A:
23.44
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.
2oap TYPE II SECRETION
SYSTEM PROTEIN

(Archaeoglobus
fulgidus) 		PF00437
(T2SSE) 		4 VAL 1 342
LEU 1 364
ILE 1 264
VAL 1 383
 None
 0.76A 4a9kA-2oap1:
undetectable		 4a9kA-2oap1:
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.
2ool SENSOR PROTEIN

(Rhodopseudomonas
palustris) 		PF01590
(GAF)
PF08446
(PAS_2) 		4 VAL A  62
LEU A  73
ILE A  55
VAL A 109
 None
 0.67A 4a9kA-2oolA:
undetectable		 4a9kA-2oolA:
16.86
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.
2p8u HYDROXYMETHYLGLUTARY
L-COA SYNTHASE,
CYTOPLASMIC

(Homo sapiens) 		PF01154
(HMG_CoA_synt_N)
PF08540
(HMG_CoA_synt_C) 		4 VAL A 136
LEU A 179
ILE A  19
VAL A 349
 None
 0.93A 4a9kA-2p8uA:
undetectable		 4a9kA-2p8uA:
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.
2pq6 UDP-GLUCURONOSYL/UDP
-GLUCOSYLTRANSFERASE

(Medicago
truncatula) 		PF00201
(UDPGT) 		4 VAL A 473
LEU A 470
ILE A 255
VAL A 123
 None
 0.75A 4a9kA-2pq6A:
undetectable		 4a9kA-2pq6A:
15.01
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.
2qr3 TWO-COMPONENT SYSTEM
RESPONSE REGULATOR

(Bacteroides
fragilis) 		PF00072
(Response_reg) 		4 VAL A  17
LEU A  21
ILE A   4
VAL A 105
 None
 0.88A 4a9kA-2qr3A:
undetectable		 4a9kA-2qr3A:
18.38
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2wp1 BROMODOMAIN
TESTIS-SPECIFIC
PROTEIN

(Mus musculus) 		PF00439
(Bromodomain) 		5 VAL A 298
LEU A 303
TYR A 350
ASN A 351
VAL A 357
 None
 0.40A 4a9kA-2wp1A:
17.5		 4a9kA-2wp1A:
34.13
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.
2xde GAG POLYPROTEIN

(Human
immunodeficiency
virus 1) 		PF00607
(Gag_p24) 		4 VAL A  36
LEU A 138
ILE A 141
VAL A  59
 None
 0.93A 4a9kA-2xdeA:
undetectable		 4a9kA-2xdeA:
21.77
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2yek BROMODOMAIN-CONTAINI
NG PROTEIN 2

(Homo sapiens) 		PF00439
(Bromodomain) 		4 VAL A 103
LEU A 108
TYR A 155
ASN A 156
 EAM  A1188 (-4.4A)
EAM  A1188 ( 3.8A)
None
EAM  A1188 (-3.2A)
 0.47A 4a9kA-2yekA:
17.8		 4a9kA-2yekA:
34.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ynm LIGHT-INDEPENDENT
PROTOCHLOROPHYLLIDE
REDUCTASE SUBUNIT N

(Prochlorococcus
marinus) 		PF00148
(Oxidored_nitro) 		4 VAL C  84
LEU C  97
ILE C 129
VAL C  37
 None
 0.94A 4a9kA-2ynmC:
undetectable		 4a9kA-2ynmC:
14.18
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.
3abz BETA-GLUCOSIDASE I

(Kluyveromyces
marxianus) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C)
PF07691
(PA14)
PF14310
(Fn3-like) 		4 VAL A 149
LEU A 207
ILE A 211
VAL A 164
 None
 0.76A 4a9kA-3abzA:
undetectable		 4a9kA-3abzA:
9.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3del ARGININE BINDING
PROTEIN

(Chlamydia
trachomatis) 		PF00497
(SBP_bac_3) 		4 VAL B 186
LEU B 126
ILE B 207
VAL B 162
 None
 0.95A 4a9kA-3delB:
undetectable		 4a9kA-3delB:
21.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3dew TRANSCRIPTIONAL
REGULATOR, TETR
FAMILY

(Geobacter
sulfurreducens) 		PF00440
(TetR_N) 		4 LEU A 128
ILE A 125
ASN A 159
VAL A 158
 None
None
ACY  A 209 (-3.4A)
None
 0.86A 4a9kA-3dewA:
undetectable		 4a9kA-3dewA:
21.95
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.
3gqs ADENYLATE
CYCLASE-LIKE PROTEIN

(Chlamydia
trachomatis) 		PF16697
(Yop-YscD_cpl) 		4 VAL A  29
LEU A  40
ILE A  45
VAL A  90
 None
 0.95A 4a9kA-3gqsA:
undetectable		 4a9kA-3gqsA:
19.67
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.
3gr8 NADPH DEHYDROGENASE

(Geobacillus
kaustophilus) 		PF00724
(Oxidored_FMN) 		4 VAL A 160
LEU A  14
ILE A  11
VAL A  21
 None
 0.94A 4a9kA-3gr8A:
undetectable		 4a9kA-3gr8A:
16.47
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.
3j31 COAT PROTEIN

(Sulfolobus
turreted
icosahedral
virus 1) 		no annotation 4 VAL A  36
LEU A 134
ILE A  23
VAL A  62
 None
 0.82A 4a9kA-3j31A:
undetectable		 4a9kA-3j31A:
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.
3lgx D-ALANINE--POLY(PHOS
PHORIBITOL) LIGASE
SUBUNIT 1

(Streptococcus
pyogenes) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		4 LEU A 410
TYR A 432
ASN A 506
VAL A 505
 None
 0.91A 4a9kA-3lgxA:
undetectable		 4a9kA-3lgxA:
13.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3npk GERANYLTRANSTRANSFER
ASE

(Campylobacter
jejuni) 		PF00348
(polyprenyl_synt) 		4 VAL A  63
LEU A 124
ILE A 128
VAL A  49
 None
 0.93A 4a9kA-3npkA:
2.6		 4a9kA-3npkA:
18.25
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.
3o26 SALUTARIDINE
REDUCTASE

(Papaver
somniferum) 		PF00106
(adh_short)
PF13561
(adh_short_C2) 		4 VAL A  16
LEU A  92
ILE A  85
VAL A 159
 None
 0.91A 4a9kA-3o26A:
undetectable		 4a9kA-3o26A:
16.72
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.
3p9v UNCHARACTERIZED
PROTEIN

(Marinobacter
hydrocarbonoclasticus) 		PF10604
(Polyketide_cyc2) 		4 VAL A 120
LEU A 122
ILE A 130
VAL A  57
 None
 0.94A 4a9kA-3p9vA:
undetectable		 4a9kA-3p9vA:
24.34
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.
3pmo UDP-3-O-[3-HYDROXYMY
RISTOYL] GLUCOSAMINE
N-ACYLTRANSFERASE

(Pseudomonas
aeruginosa) 		PF00132
(Hexapep)
PF04613
(LpxD) 		4 VAL A 161
LEU A 163
ILE A 145
VAL A 173
 None
 0.94A 4a9kA-3pmoA:
undetectable		 4a9kA-3pmoA:
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.
3qz5 CO-TYPE NITRILE
HYDRATASE ALPHA
SUBUNIT

(Pseudomonas
putida) 		PF02979
(NHase_alpha) 		4 LEU A 147
ILE A 154
ASN A 102
VAL A 173
 None
 0.89A 4a9kA-3qz5A:
undetectable		 4a9kA-3qz5A:
19.31
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.
3sql GLYCOSYL HYDROLASE
FAMILY 3

(Synechococcus
sp. PCC 7002) 		PF00933
(Glyco_hydro_3) 		4 LEU A 242
ILE A 211
ASN A 156
VAL A 158
 None
 0.92A 4a9kA-3sqlA:
undetectable		 4a9kA-3sqlA:
13.78
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.
3tz6 ASPARTATE-SEMIALDEHY
DE DEHYDROGENASE

(Mycobacterium
tuberculosis) 		PF01118
(Semialdhyde_dh)
PF02774
(Semialdhyde_dhC) 		4 VAL A 302
LEU A 319
ILE A 305
VAL A 141
 None
 0.95A 4a9kA-3tz6A:
undetectable		 4a9kA-3tz6A:
17.49
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.
3w1z HEAT SHOCK PROTEIN
16

(Schizosaccharomyces
pombe) 		PF00011
(HSP20) 		4 VAL A  50
LEU A 128
ILE A 106
VAL A  64
 None
 0.95A 4a9kA-3w1zA:
undetectable		 4a9kA-3w1zA:
16.90
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.
3ypi TRIOSEPHOSPHATE
ISOMERASE

(Saccharomyces
cerevisiae) 		PF00121
(TIM) 		4 VAL A 150
LEU A 147
ILE A 127
VAL A 160
 None
 0.89A 4a9kA-3ypiA:
undetectable		 4a9kA-3ypiA:
18.22
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.
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) 		4 VAL A 781
LEU A 785
ILE A 787
VAL A 756
 None
 0.94A 4a9kA-3zyvA:
2.1		 4a9kA-3zyvA:
6.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4b2q ATP SYNTHASE SUBUNIT
DELTA, MITOCHONDRIAL

(Saccharomyces
cerevisiae) 		PF02823
(ATP-synt_DE_N) 		4 VAL H  85
LEU H  52
ILE H  70
VAL H  30
 None
 0.83A 4a9kA-4b2qH:
undetectable		 4a9kA-4b2qH:
24.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4c0h MRNA CLEAVAGE AND
POLYADENYLATION
FACTOR CLP1

(Saccharomyces
cerevisiae) 		PF06807
(Clp1)
PF16573
(CLP1_N)
PF16575
(CLP1_P) 		4 VAL A 250
LEU A 160
ILE A 268
VAL A 233
 None
 0.94A 4a9kA-4c0hA:
undetectable		 4a9kA-4c0hA:
15.08
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.
4cak INTEGRIN ALPHA-IIB

(Homo sapiens) 		PF01839
(FG-GAP)
PF08441
(Integrin_alpha2) 		4 VAL A 888
LEU A 803
ILE A 815
VAL A 903
 None
 0.74A 4a9kA-4cakA:
undetectable		 4a9kA-4cakA:
8.16
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.
4cak INTEGRIN BETA-3

(Homo sapiens) 		PF00362
(Integrin_beta)
PF07965
(Integrin_B_tail)
PF07974
(EGF_2)
PF17205
(PSI_integrin) 		4 VAL B 340
LEU B 134
ILE B 131
VAL B 247
 None
 0.85A 4a9kA-4cakB:
undetectable		 4a9kA-4cakB:
11.13
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.
4chc POLYMERASE ACIDIC
PROTEIN

(Thogoto
thogotovirus) 		no annotation 4 VAL A  34
LEU A 100
ILE A 165
VAL A 152
 None
 0.91A 4a9kA-4chcA:
3.7		 4a9kA-4chcA:
23.50
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.
4fbd PUTATIVE
UNCHARACTERIZED
PROTEIN

(Toxoplasma
gondii) 		PF11539
(DUF3228) 		4 VAL A  54
LEU A 136
ILE A 167
VAL A  83
 None
 0.94A 4a9kA-4fbdA:
undetectable		 4a9kA-4fbdA:
19.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4fho INTERNALIN C2

(Listeria
monocytogenes) 		PF12354
(Internalin_N)
PF12799
(LRR_4)
PF13516
(LRR_6) 		4 VAL A 157
LEU A 182
ILE A 179
ASN A 196
 None
 0.90A 4a9kA-4fhoA:
undetectable		 4a9kA-4fhoA:
19.31
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.
4gow CALMODULIN
POTASSIUM
VOLTAGE-GATED
CHANNEL SUBFAMILY
KQT MEMBER 4

(Homo sapiens) 		PF03520
(KCNQ_channel)
PF13499
(EF-hand_7) 		4 VAL D 108
LEU D 105
ILE D 100
VAL A 530
 VAL  D 108 ( 0.6A)
LEU  D 105 ( 0.6A)
ILE  D 100 ( 0.7A)
VAL  A 530 ( 0.6A)
 0.63A 4a9kA-4gowD:
undetectable		 4a9kA-4gowD:
23.03
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.
4gpd APO-D-GLYCERALDEHYDE
-3-PHOSPHATE
DEHYDROGENASE

(Homarus
americanus) 		PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C) 		4 VAL 1  92
LEU 1 324
ILE 1 321
VAL 1  27
 None
 0.84A 4a9kA-4gpd1:
undetectable		 4a9kA-4gpd1:
14.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4hbx BROMODOMAIN-CONTAINI
NG PROTEIN 4

(Homo sapiens) 		PF00439
(Bromodomain) 		4 VAL A  87
LEU A  92
TYR A 139
ASN A 140
 14X  A 201 (-4.7A)
14X  A 201 (-4.4A)
None
14X  A 201 (-3.1A)
 0.56A 4a9kA-4hbxA:
16.9		 4a9kA-4hbxA:
32.33
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.
4ip4 MANDELATE
RACEMASE/MUCONATE
LACTONIZING
ENZYME-LIKE PROTEIN

(Ruegeria sp.
TM1040) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 VAL A 118
LEU A  39
ILE A   4
VAL A  91
 None
 0.64A 4a9kA-4ip4A:
undetectable		 4a9kA-4ip4A:
13.99
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.
4j0x RIBOSOMAL
RNA-PROCESSING
PROTEIN 9

(Saccharomyces
cerevisiae) 		PF00400
(WD40) 		4 VAL A 486
LEU A 140
ILE A 142
VAL A 526
 None
 0.90A 4a9kA-4j0xA:
undetectable		 4a9kA-4j0xA:
15.18
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.
4kr9 PROBABLE TRNA
SULFURTRANSFERASE

(Thermotoga
maritima) 		PF02568
(ThiI)
PF02926
(THUMP) 		4 VAL A   9
LEU A  61
ILE A  64
VAL A  40
 None
 0.87A 4a9kA-4kr9A:
undetectable		 4a9kA-4kr9A:
15.14
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4n3w CREB-BINDING PROTEIN

(Homo sapiens) 		PF00439
(Bromodomain)
PF06001
(DUF902) 		6 VAL A1115
LEU A1120
ILE A1122
TYR A1167
ASN A1168
VAL A1174
 None
 0.78A 4a9kA-4n3wA:
17.7		 4a9kA-4n3wA:
98.32
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.
4o1j CARBONIC ANHYDRASE

(Sordaria
macrospora) 		PF00484
(Pro_CA) 		4 VAL A  88
LEU A  41
ILE A  96
ASN A 166
 None
 0.92A 4a9kA-4o1jA:
undetectable		 4a9kA-4o1jA:
18.85
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.
4p0v FARNESYL
PYROPHOSPHATE
SYNTHASE

(Homo sapiens) 		PF00348
(polyprenyl_synt) 		4 VAL A 124
TYR A  51
ASN A  52
VAL A 101
 None
 0.95A 4a9kA-4p0vA:
undetectable		 4a9kA-4p0vA:
17.65
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.
4qku HYDROLASE

(Burkholderia
cenocepacia) 		PF01557
(FAA_hydrolase)
PF09298
(FAA_hydrolase_N) 		4 VAL A 134
LEU A  82
ILE A  86
VAL A 244
 None
 0.93A 4a9kA-4qkuA:
undetectable		 4a9kA-4qkuA:
14.39
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4uyd BROMODOMAIN-CONTAINI
NG PROTEIN 4

(Homo sapiens) 		PF00439
(Bromodomain) 		4 VAL A  87
LEU A  92
TYR A 139
ASN A 140
 V1T  A1171 (-4.9A)
V1T  A1171 (-3.8A)
None
V1T  A1171 (-3.1A)
 0.56A 4a9kA-4uydA:
17.1		 4a9kA-4uydA:
33.79
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4uyg BROMODOMAIN-CONTAINI
NG PROTEIN 2

(Homo sapiens) 		PF00439
(Bromodomain) 		5 VAL A 376
LEU A 381
TYR A 428
ASN A 429
VAL A 435
 73B  A1456 (-4.0A)
73B  A1456 (-4.9A)
None
73B  A1456 (-3.3A)
73B  A1456 (-4.1A)
 0.52A 4a9kA-4uygA:
17.8		 4a9kA-4uygA:
31.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4yhc STEROL REGULATORY
ELEMENT-BINDING
PROTEIN
CLEAVAGE-ACTIVATING
PROTEIN

(Schizosaccharomyces
pombe) 		no annotation 4 VAL A 809
LEU A 825
ILE A 828
VAL A 835
 None
 0.89A 4a9kA-4yhcA:
undetectable		 4a9kA-4yhcA:
14.41
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4z93 BROMODOMAIN-CONTAINI
NG PROTEIN 4

(Homo sapiens) 		PF00439
(Bromodomain) 		5 VAL A 380
LEU A 385
TYR A 432
ASN A 433
VAL A 439
 4LD  A 501 ( 3.8A)
4LD  A 501 (-4.1A)
4LD  A 501 ( 3.9A)
4LD  A 501 (-2.8A)
4LD  A 501 (-3.5A)
 0.52A 4a9kA-4z93A:
17.7		 4a9kA-4z93A:
36.89
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.
5cyk RIBOSOME BIOGENESIS
PROTEIN YTM1

(Chaetomium
thermophilum) 		PF00400
(WD40)
PF08154
(NLE) 		4 LEU A  93
ILE A  67
TYR A  79
VAL A  15
 None
 0.92A 4a9kA-5cykA:
undetectable		 4a9kA-5cykA:
13.66
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.
5dzz DESMOPLAKIN

(Homo sapiens) 		PF00681
(Plectin) 		4 LEU A2201
ILE A2018
TYR A2183
VAL A2181
 None
 0.72A 4a9kA-5dzzA:
undetectable		 4a9kA-5dzzA:
15.43
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.
5fl7 ATP SYNTHASE DELTA
CHAIN, MITOCHONDRIAL

(Yarrowia
lipolytica) 		PF02823
(ATP-synt_DE_N) 		4 VAL H  84
LEU H  50
ILE H  69
VAL H  28
 None
 0.92A 4a9kA-5fl7H:
undetectable		 4a9kA-5fl7H:
20.71
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.
5grs STEROL REGULATORY
ELEMENT-BINDING
PROTEIN
CLEAVAGE-ACTIVATING
PROTEIN

(Schizosaccharomyces
pombe) 		no annotation 4 VAL A 809
LEU A 825
ILE A 828
VAL A 835
 None
 0.94A 4a9kA-5grsA:
undetectable		 4a9kA-5grsA:
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.
5grs STEROL REGULATORY
ELEMENT-BINDING
PROTEIN
CLEAVAGE-ACTIVATING
PROTEIN

(Schizosaccharomyces
pombe) 		no annotation 4 VAL I1030
LEU A 624
ILE I1052
VAL I1043
 None
 0.93A 4a9kA-5grsI:
undetectable		 4a9kA-5grsI:
20.77
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5hjc BROMODOMAIN-CONTAINI
NG PROTEIN 3

(Homo sapiens) 		PF00439
(Bromodomain) 		5 VAL A 338
LEU A 343
TYR A 390
ASN A 391
VAL A 397
 None
 0.52A 4a9kA-5hjcA:
18.0		 4a9kA-5hjcA:
37.72
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.
5hn7 FARNESYL
PYROPHOSPHATE
SYNTHASE, PUTATIVE

(Plasmodium
vivax) 		PF00348
(polyprenyl_synt) 		4 VAL A 147
TYR A  75
ASN A  76
VAL A 124
 None
 0.95A 4a9kA-5hn7A:
undetectable		 4a9kA-5hn7A:
13.03
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5i8g CREB-BINDING PROTEIN

(Homo sapiens) 		PF00439
(Bromodomain)
PF06001
(DUF902) 		6 VAL A1115
LEU A1120
ILE A1122
TYR A1167
ASN A1168
VAL A1174
 69E  A1404 (-4.3A)
69E  A1404 (-4.2A)
69E  A1404 ( 4.7A)
69E  A1404 (-4.8A)
69E  A1404 (-3.0A)
69E  A1404 (-4.8A)
 0.82A 4a9kA-5i8gA:
18.8		 4a9kA-5i8gA:
88.15
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.
5ip9 DNA-DIRECTED RNA
POLYMERASE II
SUBUNIT RPB1

(Saccharomyces
cerevisiae) 		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) 		4 VAL A 990
LEU A1046
ILE A1049
VAL A1031
 None
 0.84A 4a9kA-5ip9A:
undetectable		 4a9kA-5ip9A:
6.46
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.
5kh6 HISTONE-LYSINE
N-METHYLTRANSFERASE
SETDB1

(Homo sapiens) 		no annotation 4 VAL A 346
LEU A 395
ILE A 354
VAL A 370
 None
 0.93A 4a9kA-5kh6A:
undetectable		 4a9kA-5kh6A:
20.29
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.
5l51 (-)-MENTHONE:(+)-NEO
MENTHOL REDUCTASE

(Mentha x
piperita) 		PF00106
(adh_short)
PF13561
(adh_short_C2) 		4 VAL A  17
LEU A  96
ILE A  89
VAL A 167
 None
 0.94A 4a9kA-5l51A:
undetectable		 4a9kA-5l51A:
16.21
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5lkz HISTONE
ACETYLTRANSFERASE
P300,HISTONE
ACETYLTRANSFERASE
P300

(Homo sapiens) 		PF00439
(Bromodomain)
PF06001
(DUF902)
PF08214
(HAT_KAT11) 		5 VAL A1079
LEU A1084
TYR A1131
ASN A1132
VAL A1138
 None
 0.72A 4a9kA-5lkzA:
21.7		 4a9kA-5lkzA:
87.60
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5lpk HISTONE
ACETYLTRANSFERASE
P300

(Homo sapiens) 		PF00439
(Bromodomain) 		6 VAL A1079
LEU A1084
ILE A1086
TYR A1131
ASN A1132
VAL A1138
 XDM  A1201 (-4.7A)
XDM  A1201 ( 4.4A)
None
XDM  A1201 (-4.4A)
XDM  A1201 (-3.1A)
None
 0.49A 4a9kA-5lpkA:
22.5		 4a9kA-5lpkA:
91.80
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.
5lpn RAS-RELATED PROTEIN
RAB-10

(Homo sapiens) 		PF00071
(Ras) 		4 LEU A  87
ILE A  15
TYR A  79
VAL A 115
 None
 0.88A 4a9kA-5lpnA:
undetectable		 4a9kA-5lpnA:
21.71
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5n13 BROMODOMAIN-CONTAINI
NG FACTOR 1

(Candida
albicans) 		PF00439
(Bromodomain) 		4 VAL A 415
ILE A 422
ASN A 468
VAL A 474
 GOL  A 502 ( 4.0A)
None
GOL  A 501 (-3.1A)
None
 0.59A 4a9kA-5n13A:
16.7		 4a9kA-5n13A:
33.33
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.
5nug CYTOPLASMIC DYNEIN 1
HEAVY CHAIN 1

(Homo sapiens) 		PF03028
(Dynein_heavy)
PF07728
(AAA_5)
PF08393
(DHC_N2)
PF12774
(AAA_6)
PF12775
(AAA_7)
PF12777
(MT)
PF12780
(AAA_8)
PF12781
(AAA_9) 		4 VAL A1582
LEU A1475
ILE A1487
VAL A1597
 None
 0.94A 4a9kA-5nugA:
undetectable		 4a9kA-5nugA:
2.31
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.
5oen INTERFERON
REGULATORY FACTOR 9

(Mus musculus) 		no annotation 4 VAL A 273
LEU A 269
ILE A 290
VAL A 362
 None
 0.84A 4a9kA-5oenA:
undetectable		 4a9kA-5oenA:
18.58
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.
5szj RAS-RELATED PROTEIN
RAB-10

(Homo sapiens) 		PF00071
(Ras) 		4 LEU A  87
ILE A  15
TYR A  79
VAL A 115
 None
 0.92A 4a9kA-5szjA:
undetectable		 4a9kA-5szjA:
20.81
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.
5szr PROTEIN PCDHGB2

(Mus musculus) 		PF00028
(Cadherin) 		4 VAL A 484
LEU A 502
ILE A 461
VAL A 520
 None
 0.89A 4a9kA-5szrA:
undetectable		 4a9kA-5szrA:
15.14
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.
5t9t PROTOCADHERIN GAMMA
B2-ALPHA C

(Mus musculus) 		PF00028
(Cadherin)
PF08266
(Cadherin_2) 		4 VAL A 484
LEU A 502
ILE A 461
VAL A 520
 None
 0.89A 4a9kA-5t9tA:
undetectable		 4a9kA-5t9tA:
14.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5twb FERREDOXIN--NADP
REDUCTASE

(Staphylococcus
aureus) 		PF07992
(Pyr_redox_2) 		4 VAL A  83
LEU A 251
ILE A 113
VAL A 109
 FAD  A 401 (-3.9A)
FAD  A 401 ( 3.9A)
FAD  A 401 (-3.6A)
None
 0.92A 4a9kA-5twbA:
undetectable		 4a9kA-5twbA:
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.
5u47 PENICILLIN BINDING
PROTEIN 2X

(Streptococcus
thermophilus) 		PF00905
(Transpeptidase)
PF03717
(PBP_dimer)
PF03793
(PASTA) 		4 VAL A 552
LEU A 533
ASN A 611
VAL A 610
 None
 0.92A 4a9kA-5u47A:
undetectable		 4a9kA-5u47A:
10.48
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5u6v BROMODOMAIN-CONTAINI
NG PROTEIN 2

(Homo sapiens) 		no annotation 5 VAL A 376
LEU A 381
TYR A 428
ASN A 429
VAL A 435
 7WY  A 501 ( 4.5A)
7WY  A 501 (-4.9A)
None
7WY  A 501 (-3.4A)
7WY  A 501 (-4.1A)
 0.58A 4a9kA-5u6vA:
17.7		 4a9kA-5u6vA:
36.54
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5u7g CREB-BINDING PROTEIN

(Mus musculus) 		PF00439
(Bromodomain)
PF00569
(ZZ)
PF06001
(DUF902)
PF08214
(HAT_KAT11) 		6 VAL A1116
LEU A1121
ILE A1123
TYR A1168
ASN A1169
VAL A1175
 None
 0.52A 4a9kA-5u7gA:
19.8		 4a9kA-5u7gA:
94.40
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.
5ulu CADHERIN-23

(Mus musculus) 		no annotation 4 VAL A2217
LEU A2235
ILE A2188
VAL A2258
 None
 0.84A 4a9kA-5uluA:
undetectable		 4a9kA-5uluA:
21.37
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.
5um2 ABC TRANSPORTER
SULFATE BINDING
PROTEIN

(Xanthomonas
citri) 		PF13531
(SBP_bac_11) 		5 VAL A 111
LEU A 295
TYR A  67
ASN A  71
VAL A  89
 None
 1.33A 4a9kA-5um2A:
undetectable		 4a9kA-5um2A:
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.
5umx GLYOXALASE/BLEOMYCIN
RESISANCE
PROTEIN/DIOXYGENASE

(Streptomyces
sp. CB03234) 		no annotation 4 VAL A  11
LEU A  71
ILE A 114
VAL A  45
 None
 0.95A 4a9kA-5umxA:
undetectable		 4a9kA-5umxA:
22.41
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5vbr BROMODOMAIN
TESTIS-SPECIFIC
PROTEIN

(Homo sapiens) 		no annotation 4 VAL A  56
LEU A  61
TYR A 108
ASN A 109
 IBI  A 201 ( 4.6A)
IBI  A 201 (-4.2A)
IBI  A 201 ( 4.5A)
IBI  A 201 (-3.3A)
 0.77A 4a9kA-5vbrA:
17.4		 4a9kA-5vbrA:
34.12
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.
5vvm CADHERIN-23

(Homo sapiens) 		no annotation 4 VAL A2217
LEU A2235
ILE A2188
VAL A2258
 None
 0.91A 4a9kA-5vvmA:
undetectable		 4a9kA-5vvmA:
20.34
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5w0e CREB-BINDING PROTEIN

(Homo sapiens) 		no annotation 6 VAL A1115
LEU A1120
ILE A1122
TYR A1167
ASN A1168
VAL A1174
 9U4  A1201 (-4.6A)
9U4  A1201 ( 4.1A)
9U4  A1201 (-4.3A)
None
9U4  A1201 (-3.2A)
9U4  A1201 (-4.7A)
 0.56A 4a9kA-5w0eA:
22.4		 4a9kA-5w0eA:
75.76
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.
5xhu FERREDOXIN--NADP
REDUCTASE

(Bacillus
subtilis) 		no annotation 4 VAL A 159
LEU A 244
ILE A 223
VAL A 228
 None
 0.92A 4a9kA-5xhuA:
undetectable		 4a9kA-5xhuA:
18.33
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6cw0 CGD2_2690 PROTEIN

(Cryptosporidium
parvum) 		no annotation 5 VAL A  30
LEU A  35
TYR A  82
ASN A  83
VAL A  89
 R78  A 201 (-4.5A)
R78  A 201 (-4.9A)
UNX  A 203 ( 4.1A)
R78  A 201 (-3.3A)
UNX  A 205 ( 4.1A)
 0.47A 4a9kA-6cw0A:
17.9		 4a9kA-6cw0A:
38.20
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.
6dne BROMODOMAIN-CONTAINI
NG PROTEIN 4

(Homo sapiens) 		no annotation 4 VAL A  87
LEU A  92
TYR A 139
ASN A 140
 H1V  A 501 ( 4.4A)
H1V  A 501 (-4.2A)
None
H1V  A 501 (-3.2A)
 0.57A 4a9kA-6dneA:
16.6		 4a9kA-6dneA:
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.
6f6e RIBONUCLEOTIDE
REDUCTASE SMALL
SUBUNIT

(Geobacillus
kaustophilus) 		no annotation 4 LEU A  95
ILE A  76
TYR A 162
ASN A 163
 None
None
PLM  A 404 (-4.3A)
None
 0.95A 4a9kA-6f6eA:
undetectable		 4a9kA-6f6eA:
16.95