SIMILAR PATTERNS OF AMINO ACIDS FOR 3U5K_A_08JA1

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
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1e6i TRANSCRIPTIONAL
ACTIVATOR GCN5


(Saccharomyces
cerevisiae)
PF00439
(Bromodomain)
4 TRP A 350
PRO A 351
VAL A 356
ASN A 407
None
0.56A 3u5kA-1e6iA:
16.0
3u5kA-1e6iA:
34.65
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.
1im4 DBH

(Sulfolobus
solfataricus)
PF00817
(IMS)
PF11798
(IMS_HHH)
5 PRO A 185
LEU A 179
LEU A 176
ASN A 148
ILE A 150
None
1.37A 3u5kA-1im4A:
undetectable
3u5kA-1im4A:
20.54
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.
1kcz BETA-METHYLASPARTASE

(Clostridium
tetanomorphum)
PF05034
(MAAL_N)
PF07476
(MAAL_C)
4 VAL A 239
LEU A 211
LEU A 204
ILE A 258
None
0.87A 3u5kA-1kczA:
0.0
3u5kA-1kczA:
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.
1kzh PHOSPHOFRUCTOKINASE

(Borreliella
burgdorferi)
PF00365
(PFK)
4 PRO A 202
LEU A 482
ASN A 211
ILE A 214
None
0.90A 3u5kA-1kzhA:
0.0
3u5kA-1kzhA:
13.46
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.
1mr2 ADPR PYROPHOSPHATASE

(Mycobacterium
tuberculosis)
PF00293
(NUDIX)
4 VAL A  98
LEU A 100
LEU A  94
ILE A  57
None
0.85A 3u5kA-1mr2A:
1.0
3u5kA-1mr2A:
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.
1q1q SULFOTRANSFERASE
FAMILY, CYTOSOLIC,
2B, MEMBER 1 ISOFORM
A


(Homo sapiens)
PF00685
(Sulfotransfer_1)
4 VAL A 225
LEU A 222
LEU A 217
ILE A 209
None
0.89A 3u5kA-1q1qA:
undetectable
3u5kA-1q1qA:
14.53
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.
1tdf THIOREDOXIN
REDUCTASE


(Escherichia
coli)
PF07992
(Pyr_redox_2)
5 PRO A  53
VAL A  49
LEU A  64
LEU A  43
ILE A 296
None
FAD  A 500 (-3.4A)
None
FAD  A 500 (-3.3A)
None
0.98A 3u5kA-1tdfA:
undetectable
3u5kA-1tdfA:
16.77
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.
1vdc NADPH DEPENDENT
THIOREDOXIN
REDUCTASE


(Arabidopsis
thaliana)
PF07992
(Pyr_redox_2)
4 PRO A  53
LEU A  64
LEU A  43
ILE A 296
None
None
FAD  A 400 (-4.1A)
None
0.89A 3u5kA-1vdcA:
undetectable
3u5kA-1vdcA:
15.06
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.
1yfy 3-HYDROXYANTHRANILAT
E-3,4-DIOXYGENASE


(Cupriavidus
metallidurans)
PF06052
(3-HAO)
4 TRP A  31
VAL A  40
LEU A 107
LEU A  62
None
0.85A 3u5kA-1yfyA:
undetectable
3u5kA-1yfyA:
18.97
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.
2aaz THYMIDYLATE SYNTHASE

(Cryptococcus
neoformans)
PF00303
(Thymidylat_synt)
4 VAL A 302
LEU A 280
LEU A  63
ILE A  77
None
0.83A 3u5kA-2aazA:
undetectable
3u5kA-2aazA:
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.
2bac PUTATIVE
AMINOOXIDASE


(Cutibacterium
acnes)
PF01593
(Amino_oxidase)
4 VAL A 181
LEU A 185
ILE A 162
MET A 302
None
0.83A 3u5kA-2bacA:
undetectable
3u5kA-2bacA:
14.96
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.
2cb1 O-ACETYL HOMOSERINE
SULFHYDRYLASE


(Thermus
thermophilus)
PF01053
(Cys_Met_Meta_PP)
4 VAL A 389
LEU A 333
LEU A 335
ILE A 348
None
0.89A 3u5kA-2cb1A:
undetectable
3u5kA-2cb1A:
13.51
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)
8 TRP A  31
PRO A  32
VAL A  37
LEU A  42
LEU A  44
ASN A  90
ILE A  96
MET A  99
None
0.39A 3u5kA-2dvrA:
20.8
3u5kA-2dvrA:
70.08
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.
2gsk VITAMIN B12
TRANSPORTER BTUB


(Escherichia
coli)
PF00593
(TonB_dep_Rec)
PF07715
(Plug)
4 PRO A 412
LEU A 401
LEU A 398
ASN A 362
None
0.79A 3u5kA-2gskA:
undetectable
3u5kA-2gskA:
11.19
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.
2i88 COLICIN-E1

(Escherichia
coli)
PF01024
(Colicin)
4 TRP A 460
VAL A 447
LEU A 486
ILE A 503
None
0.88A 3u5kA-2i88A:
undetectable
3u5kA-2i88A:
19.57
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.
2it1 362AA LONG
HYPOTHETICAL
MALTOSE/MALTODEXTRIN
TRANSPORT
ATP-BINDING PROTEIN


(Pyrococcus
horikoshii)
PF00005
(ABC_tran)
4 VAL A 172
LEU A 161
LEU A 164
ILE A 144
None
0.85A 3u5kA-2it1A:
undetectable
3u5kA-2it1A:
15.64
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2l5e BROMODOMAIN-CONTAINI
NG PROTEIN 3


(Mus musculus)
PF00439
(Bromodomain)
6 PRO A  58
LEU A  68
LEU A  70
ASN A 116
ILE A 122
MET A 125
None
0.87A 3u5kA-2l5eA:
17.3
3u5kA-2l5eA:
77.17
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2l5e BROMODOMAIN-CONTAINI
NG PROTEIN 3


(Mus musculus)
PF00439
(Bromodomain)
6 TRP A  57
PRO A  58
LEU A  70
ASN A 116
ILE A 122
MET A 125
None
0.87A 3u5kA-2l5eA:
17.3
3u5kA-2l5eA:
77.17
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.
2okc TYPE I RESTRICTION
ENZYME STYSJI M
PROTEIN


(Bacteroides
thetaiotaomicron)
PF02384
(N6_Mtase)
PF12161
(HsdM_N)
4 PRO A 177
LEU A 185
ILE A 256
MET A 292
None
0.89A 3u5kA-2okcA:
undetectable
3u5kA-2okcA:
13.53
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.
2p2s PUTATIVE
OXIDOREDUCTASE


(Pectobacterium
atrosepticum)
PF01408
(GFO_IDH_MocA)
PF02894
(GFO_IDH_MocA_C)
4 VAL A 108
LEU A 105
LEU A  99
ILE A 317
None
0.83A 3u5kA-2p2sA:
undetectable
3u5kA-2p2sA:
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.
2pqd 3-PHOSPHOSHIKIMATE
1-CARBOXYVINYLTRANSF
ERASE


(Agrobacterium
sp.)
PF00275
(EPSP_synthase)
4 PRO A 329
VAL A 333
LEU A 365
ILE A 406
None
0.90A 3u5kA-2pqdA:
undetectable
3u5kA-2pqdA:
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.
2vgq SUGAR ABC
TRANSPORTER
SUBSTRATE-BINDING
PROTEIN,MITOCHONDRIA
L
ANTIVIRAL-SIGNALING
PROTEIN


(Escherichia
coli;
Homo sapiens)
PF13416
(SBP_bac_8)
PF16739
(CARD_2)
4 VAL A 391
LEU A 453
LEU A 445
ILE A 381
None
0.69A 3u5kA-2vgqA:
undetectable
3u5kA-2vgqA:
14.01
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)
6 TRP A 292
PRO A 293
VAL A 298
LEU A 305
ASN A 351
MET A 360
None
0.58A 3u5kA-2wp1A:
16.8
3u5kA-2wp1A:
38.17
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)
6 TRP A 292
VAL A 298
LEU A 303
LEU A 305
ASN A 351
MET A 360
None
0.65A 3u5kA-2wp1A:
16.8
3u5kA-2wp1A:
38.17
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)
8 TRP A  97
PRO A  98
VAL A 103
LEU A 108
LEU A 110
ASN A 156
ILE A 162
MET A 165
None
EAM  A1188 (-4.6A)
EAM  A1188 (-4.4A)
EAM  A1188 ( 3.8A)
EAM  A1188 (-4.5A)
EAM  A1188 (-3.2A)
EAM  A1188 (-3.8A)
EAM  A1188 ( 4.1A)
0.39A 3u5kA-2yekA:
20.6
3u5kA-2yekA:
70.07
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.
2yrr AMINOTRANSFERASE,
CLASS V


(Thermus
thermophilus)
PF00266
(Aminotran_5)
4 PRO A 294
VAL A 291
LEU A 325
LEU A 327
None
0.89A 3u5kA-2yrrA:
undetectable
3u5kA-2yrrA:
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.
2z7x TOLL-LIKE RECEPTOR
1, VARIABLE
LYMPHOCYTE RECEPTOR
B


(Eptatretus
burgeri;
Homo sapiens)
PF11921
(DUF3439)
PF13855
(LRR_8)
4 PRO B  40
LEU B  68
LEU B  71
ILE B  52
None
0.91A 3u5kA-2z7xB:
undetectable
3u5kA-2z7xB:
13.37
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.
3a75 GAMMA-GLUTAMYLTRANSP
EPTIDASE LARGE CHAIN


(Bacillus
subtilis)
PF01019
(G_glu_transpept)
4 VAL A  83
LEU A 225
ILE A 170
MET A 166
None
0.90A 3u5kA-3a75A:
undetectable
3u5kA-3a75A:
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.
3ctz XAA-PRO
AMINOPEPTIDASE 1


(Homo sapiens)
PF00557
(Peptidase_M24)
PF01321
(Creatinase_N)
PF16188
(Peptidase_M24_C)
PF16189
(Creatinase_N_2)
4 VAL A 247
LEU A 251
LEU A 253
ILE A 237
None
0.74A 3u5kA-3ctzA:
undetectable
3u5kA-3ctzA:
11.35
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.
3e4w PUTATIVE
UNCHARACTERIZED
PROTEIN


(Mycobacterium
avium)
PF00199
(Catalase)
4 VAL A 219
LEU A 214
LEU A 210
ILE A  62
None
0.89A 3u5kA-3e4wA:
undetectable
3u5kA-3e4wA:
16.14
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.
3ef1 RNA POLYMERASE II
SUBUNIT A C-TERMINAL
DOMAIN PHOSPHATASE


(Schizosaccharomyces
pombe)
PF03031
(NIF)
PF12738
(PTCB-BRCT)
4 PRO A 417
LEU A 438
LEU A 439
ILE A 321
None
0.89A 3u5kA-3ef1A:
undetectable
3u5kA-3ef1A:
16.82
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.
3gt0 PYRROLINE-5-CARBOXYL
ATE REDUCTASE


(Bacillus cereus)
PF03807
(F420_oxidored)
PF14748
(P5CR_dimer)
4 VAL A 147
LEU A 133
ILE A  96
MET A  13
None
0.82A 3u5kA-3gt0A:
undetectable
3u5kA-3gt0A:
20.82
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.
3hmh TRANSCRIPTION
INITIATION FACTOR
TFIID 210 KDA
SUBUNIT


(Homo sapiens)
PF00439
(Bromodomain)
4 TRP A1545
PRO A1546
VAL A1551
ASN A1602
None
0.77A 3u5kA-3hmhA:
12.6
3u5kA-3hmhA:
26.67
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.
3ivr PUTATIVE
LONG-CHAIN-FATTY-ACI
D COA LIGASE


(Rhodopseudomonas
palustris)
PF00501
(AMP-binding)
4 VAL A 118
LEU A 100
ILE A  62
MET A  70
None
0.86A 3u5kA-3ivrA:
undetectable
3u5kA-3ivrA:
11.33
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.
3k1r HARMONIN
USHER SYNDROME
TYPE-1G PROTEIN


(Homo sapiens)
PF00536
(SAM_1)
PF00595
(PDZ)
4 VAL A 102
LEU B 461
LEU A 100
ILE A 137
None
0.86A 3u5kA-3k1rA:
undetectable
3u5kA-3k1rA:
17.01
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.
3k2k PUTATIVE
CARBOXYPEPTIDASE


(Burkholderia
mallei)
PF00246
(Peptidase_M14)
4 VAL A 212
LEU A 148
LEU A 137
ILE A 256
None
0.76A 3u5kA-3k2kA:
undetectable
3u5kA-3k2kA:
11.87
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.
3l8d METHYLTRANSFERASE

(Bacillus
thuringiensis)
PF08241
(Methyltransf_11)
4 VAL A 200
ASN A 124
ILE A 123
MET A 121
None
0.79A 3u5kA-3l8dA:
undetectable
3u5kA-3l8dA:
19.58
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3nxb CAT EYE SYNDROME
CRITICAL REGION
PROTEIN 2


(Homo sapiens)
PF00439
(Bromodomain)
5 TRP A 457
PRO A 458
VAL A 463
ASN A 514
MET A 523
None
None
EDO  A   1 (-4.3A)
EDO  A   1 (-3.3A)
None
0.44A 3u5kA-3nxbA:
16.6
3u5kA-3nxbA:
32.56
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.
3oc6 6-PHOSPHOGLUCONOLACT
ONASE


(Mycolicibacterium
smegmatis)
PF01182
(Glucosamine_iso)
4 VAL A  54
LEU A  51
LEU A  50
ILE A  39
None
0.90A 3u5kA-3oc6A:
undetectable
3u5kA-3oc6A:
17.50
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.
3ohe HISTIDINE TRIAD
(HIT) PROTEIN


(Marinobacter
hydrocarbonoclasticus)
PF01230
(HIT)
4 PRO A  32
VAL A  34
LEU A  25
LEU A  15
None
0.81A 3u5kA-3oheA:
undetectable
3u5kA-3oheA:
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.
3p9z UROPORPHYRINOGEN III
COSYNTHASE (HEMD)


(Helicobacter
pylori)
PF02602
(HEM4)
4 VAL A 110
LEU A 126
ILE A 101
MET A  88
None
0.82A 3u5kA-3p9zA:
undetectable
3u5kA-3p9zA:
20.35
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.
3pkj NAD-DEPENDENT
DEACETYLASE
SIRTUIN-6


(Homo sapiens)
PF02146
(SIR2)
4 PRO A 290
VAL A 102
LEU A 104
LEU A  99
None
0.88A 3u5kA-3pkjA:
undetectable
3u5kA-3pkjA:
17.88
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.
3pr6 TRAPP-ASSOCIATED
PROTEIN TCA17


(Saccharomyces
cerevisiae)
PF04628
(Sedlin_N)
4 VAL A   8
LEU A  10
LEU A  19
ILE A 115
None
0.88A 3u5kA-3pr6A:
undetectable
3u5kA-3pr6A:
24.69
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3q2e BROMODOMAIN AND WD
REPEAT-CONTAINING
PROTEIN 1


(Homo sapiens)
PF00439
(Bromodomain)
4 PRO A1337
VAL A1342
ILE A1400
MET A1403
None
0.40A 3u5kA-3q2eA:
16.4
3u5kA-3q2eA:
33.58
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.
3son HYPOTHETICAL NUDIX
HYDROLASE


(Listeria
monocytogenes)
PF00293
(NUDIX)
4 VAL A 103
LEU A 112
ILE A  94
MET A  65
None
0.89A 3u5kA-3sonA:
undetectable
3u5kA-3sonA:
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.
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)
4 VAL A4688
LEU A4705
LEU A4654
ILE A4664
None
0.89A 3u5kA-3vkgA:
undetectable
3u5kA-3vkgA:
3.64
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.
3vti HYDROGENASE
MATURATION FACTOR


(Caldanaerobacter
subterraneus)
PF00586
(AIRS)
PF02769
(AIRS_C)
4 PRO C 237
LEU C 217
LEU C 220
ILE C 186
None
0.90A 3u5kA-3vtiC:
undetectable
3u5kA-3vtiC:
15.61
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.
3zxo REDOX SENSOR
HISTIDINE KINASE
RESPONSE REGULATOR
DEVS


(Mycobacterium
tuberculosis)
PF02518
(HATPase_c)
4 VAL A 485
LEU A 456
LEU A 482
ILE A 525
None
None
None
OCS  A 524 ( 4.0A)
0.87A 3u5kA-3zxoA:
undetectable
3u5kA-3zxoA:
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.
4aef NEOPULLULANASE
(ALPHA-AMYLASE II)


(Pyrococcus
furiosus)
PF00128
(Alpha-amylase)
PF02903
(Alpha-amylase_N)
PF16561
(AMPK1_CBM)
4 TRP A 400
VAL A 302
LEU A 292
ILE A 261
None
0.87A 3u5kA-4aefA:
undetectable
3u5kA-4aefA:
13.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4aij TRANSCRIPTIONAL
REGULATOR SLYA


(Yersinia
pseudotuberculosis)
PF01047
(MarR)
4 PRO A  98
VAL A 103
LEU A  27
LEU A  29
None
0.90A 3u5kA-4aijA:
undetectable
3u5kA-4aijA:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4b6z FAMILY M14
UNASSIGNED PEPTIDASE


(Burkholderia
cenocepacia)
PF00246
(Peptidase_M14)
4 VAL A 212
LEU A 148
LEU A 137
ILE A 256
None
0.75A 3u5kA-4b6zA:
undetectable
3u5kA-4b6zA:
13.15
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.
4fmz INTERNALIN

(Listeria
monocytogenes)
PF12354
(Internalin_N)
PF12799
(LRR_4)
PF13855
(LRR_8)
4 VAL A 294
LEU A 281
LEU A 303
ILE A 288
None
0.81A 3u5kA-4fmzA:
undetectable
3u5kA-4fmzA:
16.09
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.
4glx DNA LIGASE

(Escherichia
coli)
PF01653
(DNA_ligase_aden)
PF03119
(DNA_ligase_ZBD)
PF03120
(DNA_ligase_OB)
PF12826
(HHH_2)
PF14520
(HHH_5)
4 VAL A 444
LEU A 474
LEU A 500
ILE A 458
None
0.82A 3u5kA-4glxA:
undetectable
3u5kA-4glxA:
12.98
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)
8 TRP A  81
PRO A  82
VAL A  87
LEU A  92
LEU A  94
ASN A 140
ILE A 146
MET A 149
None
14X  A 201 (-4.4A)
14X  A 201 (-4.7A)
14X  A 201 (-4.4A)
None
14X  A 201 (-3.1A)
14X  A 201 ( 4.0A)
14X  A 201 (-3.5A)
0.48A 3u5kA-4hbxA:
25.0
3u5kA-4hbxA:
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.
4hvq 3-HYDROXYANTHRANILAT
E 3,4-DIOXYGENASE


(Cupriavidus
metallidurans)
PF06052
(3-HAO)
4 TRP A  31
VAL A  40
LEU A 107
LEU A  62
None
0.88A 3u5kA-4hvqA:
undetectable
3u5kA-4hvqA:
19.48
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.
4i1t RNA-DIRECTED RNA
POLYMERASE L


(Cali
mammarenavirus)
PF17296
(ArenaCapSnatch)
4 PRO A  87
LEU A 125
LEU A 129
ILE A  71
None
0.79A 3u5kA-4i1tA:
3.1
3u5kA-4i1tA:
21.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4i62 AMINO ACID ABC
TRANSPORTER,
PERIPLASMIC AMINO
ACID-BINDING
PROTEIN, PUTATIVE


(Streptococcus
pneumoniae)
PF00497
(SBP_bac_3)
4 PRO A  86
VAL A  42
LEU A  82
ILE A  63
None
0.85A 3u5kA-4i62A:
undetectable
3u5kA-4i62A:
17.88
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.
4jgf GAMMA-CRYSTALLIN D

(Homo sapiens)
PF00030
(Crystall)
4 VAL A  75
LEU A  25
LEU A  29
ILE A   3
None
0.88A 3u5kA-4jgfA:
undetectable
3u5kA-4jgfA:
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.
4k0e HEAVY METAL CATION
TRICOMPONENT EFFLUX
PUMP ZNEA(CZCA-LIKE)


(Cupriavidus
metallidurans)
PF00873
(ACR_tran)
4 VAL A  50
LEU A  92
LEU A  90
ASN A 597
None
0.87A 3u5kA-4k0eA:
undetectable
3u5kA-4k0eA:
7.27
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4ldf GCN5 LIKE ACETYLASE
+ BROMODOMAIN


(Cryptosporidium
parvum)
PF00439
(Bromodomain)
4 TRP A  31
PRO A  32
VAL A  37
ASN A  88
None
None
GOL  A 201 ( 4.9A)
GOL  A 201 (-2.7A)
0.62A 3u5kA-4ldfA:
15.2
3u5kA-4ldfA:
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.
4raa PUTATIVE EXPORTED
PROTEIN


(Bacteroides
fragilis)
PF17170
(DUF5128)
4 VAL A 182
LEU A 164
LEU A 158
ILE A 235
None
0.86A 3u5kA-4raaA:
undetectable
3u5kA-4raaA:
18.31
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.
4u09 LIC12759

(Leptospira
interrogans)
PF13855
(LRR_8)
4 VAL A 313
LEU A 299
LEU A 322
ILE A 306
None
0.87A 3u5kA-4u09A:
undetectable
3u5kA-4u09A:
14.96
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)
8 TRP A  81
PRO A  82
VAL A  87
LEU A  92
LEU A  94
ASN A 140
ILE A 146
MET A 149
None
V1T  A1171 (-4.2A)
V1T  A1171 (-4.9A)
V1T  A1171 (-3.8A)
None
V1T  A1171 (-3.1A)
DMS  A1169 ( 4.3A)
DMS  A1169 ( 3.8A)
0.25A 3u5kA-4uydA:
24.5
3u5kA-4uydA:
92.70
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)
7 TRP A 370
PRO A 371
VAL A 376
LEU A 381
LEU A 383
ASN A 429
MET A 438
None
None
73B  A1456 (-4.0A)
73B  A1456 (-4.9A)
73B  A1456 (-4.9A)
73B  A1456 (-3.3A)
73B  A1456 ( 3.8A)
0.52A 3u5kA-4uygA:
17.9
3u5kA-4uygA:
34.84
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.
4xpz RNA POLYMERASE II
SUBUNIT A C-TERMINAL
DOMAIN PHOSPHATASE


(Schizosaccharomyces
pombe)
PF03031
(NIF)
PF12738
(PTCB-BRCT)
4 PRO A 355
LEU A 376
LEU A 377
ILE A 321
PG4  A 603 (-4.5A)
None
None
None
0.85A 3u5kA-4xpzA:
undetectable
3u5kA-4xpzA:
18.08
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)
7 TRP A 374
PRO A 375
VAL A 380
LEU A 385
LEU A 387
ASN A 433
MET A 442
4LD  A 501 (-3.9A)
4LD  A 501 (-3.9A)
4LD  A 501 ( 3.8A)
4LD  A 501 (-4.1A)
4LD  A 501 (-4.4A)
4LD  A 501 (-2.8A)
4LD  A 501 ( 3.4A)
0.48A 3u5kA-4z93A:
17.8
3u5kA-4z93A:
36.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4zdk CTP SYNTHASE

(Mycobacterium
tuberculosis)
PF00117
(GATase)
PF06418
(CTP_synth_N)
4 VAL A 272
LEU A 276
LEU A 278
ILE A 150
None
0.89A 3u5kA-4zdkA:
undetectable
3u5kA-4zdkA:
11.07
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.
4zke SUPERKILLER PROTEIN
7


(Saccharomyces
cerevisiae)
PF00009
(GTP_EFTU)
4 VAL A 708
LEU A 687
LEU A 674
ILE A 659
VAL  A 708 ( 0.6A)
LEU  A 687 ( 0.6A)
LEU  A 674 ( 0.6A)
ILE  A 659 ( 0.7A)
0.85A 3u5kA-4zkeA:
undetectable
3u5kA-4zkeA:
13.76
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.
4zw0 3-HYDROXYACYL-[ACYL-
CARRIER-PROTEIN]
DEHYDRATASE FABZ


(Candidatus
Liberibacter
asiaticus)
PF07977
(FabA)
4 VAL A  28
LEU A  15
LEU A  19
ILE A  79
None
0.85A 3u5kA-4zw0A:
undetectable
3u5kA-4zw0A:
18.82
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.
5a4p UBIQUITIN-CONJUGATIN
G ENZYME E2 Z


(Homo sapiens)
PF00179
(UQ_con)
4 VAL A 187
LEU A 189
LEU A 192
MET A 119
None
0.84A 3u5kA-5a4pA:
undetectable
3u5kA-5a4pA:
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.
5fse UREASE SUBUNIT ALPHA

(Sporosarcina
pasteurii)
PF00449
(Urease_alpha)
PF01979
(Amidohydro_1)
4 VAL C 504
LEU C 508
LEU C 510
ILE C 180
None
0.89A 3u5kA-5fseC:
undetectable
3u5kA-5fseC:
10.63
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)
7 TRP A 332
PRO A 333
VAL A 338
LEU A 343
LEU A 345
ASN A 391
MET A 400
None
0.61A 3u5kA-5hjcA:
17.9
3u5kA-5hjcA:
39.29
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.
5i2c GATS-LIKE PROTEIN 3

(Homo sapiens)
PF13840
(ACT_7)
4 VAL A 133
LEU A 137
ILE A 123
MET A 114
None
0.83A 3u5kA-5i2cA:
undetectable
3u5kA-5i2cA:
13.85
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.
5iy9 DNA-DIRECTED RNA
POLYMERASE II
SUBUNIT RPB1


(Homo sapiens)
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 545
LEU A 640
LEU A 645
ILE A 595
None
0.91A 3u5kA-5iy9A:
undetectable
3u5kA-5iy9A:
4.82
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.
5izh RNA-DIRECTED RNA
POLYMERASE L


(Lassa
mammarenavirus)
PF17296
(ArenaCapSnatch)
4 PRO A  88
LEU A 126
LEU A 130
ILE A  72
None
0.79A 3u5kA-5izhA:
4.6
3u5kA-5izhA:
19.23
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.
5k66 NTA1P

(Saccharomyces
cerevisiae)
PF00795
(CN_hydrolase)
4 PRO A 219
VAL A 387
LEU A 215
ILE A 105
None
0.88A 3u5kA-5k66A:
undetectable
3u5kA-5k66A:
14.99
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.
5k9h 0940_GH29

(unidentified)
PF00754
(F5_F8_type_C)
PF01120
(Alpha_L_fucos)
4 TRP A 188
LEU A 146
LEU A 150
ILE A 204
None
0.87A 3u5kA-5k9hA:
undetectable
3u5kA-5k9hA:
9.83
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.
5lc5 NADH DEHYDROGENASE
[UBIQUINONE]
IRON-SULFUR PROTEIN
2, MITOCHONDRIAL


(Bos taurus)
PF00346
(Complex1_49kDa)
4 VAL D 184
LEU D 207
LEU D 203
ILE D 144
None
0.67A 3u5kA-5lc5D:
undetectable
3u5kA-5lc5D:
14.32
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.
5lew DNA POLYMERASE III
SUBUNIT ALPHA


(Mycobacterium
tuberculosis)
no annotation 4 VAL A 724
LEU A 700
LEU A 696
ILE A 775
None
0.89A 3u5kA-5lewA:
undetectable
3u5kA-5lewA:
8.00
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)
4 PRO A1074
VAL A1079
LEU A1084
ASN A1132
XDM  A1201 (-3.9A)
XDM  A1201 (-4.7A)
XDM  A1201 ( 4.4A)
XDM  A1201 (-3.1A)
0.60A 3u5kA-5lpkA:
17.2
3u5kA-5lpkA:
31.34
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.
5mg2 TRANSCRIPTION
INITIATION FACTOR
TFIID SUBUNIT 1


(Homo sapiens)
PF00439
(Bromodomain)
4 TRP A1526
PRO A1527
VAL A1532
ASN A1583
None
7M8  A1704 (-3.8A)
7M8  A1704 (-3.5A)
7M8  A1704 (-3.1A)
0.46A 3u5kA-5mg2A:
13.1
3u5kA-5mg2A:
28.47
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.
5ml0 HISTONE
ACETYLTRANSFERASE
KAT2B


(Mus musculus)
no annotation 4 TRP A 745
PRO A 746
VAL A 751
ASN A 802
None
P2L  A 901 (-4.7A)
P2L  A 901 ( 4.2A)
P2L  A 901 (-3.2A)
0.63A 3u5kA-5ml0A:
15.8
3u5kA-5ml0A:
26.77
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5n15 BROMODOMAIN-CONTAINI
NG FACTOR 1


(Candida
albicans)
PF00439
(Bromodomain)
5 PRO A 233
VAL A 238
ASN A 291
ILE A 297
MET A 300
IOD  A 405 ( 4.4A)
None
IOD  A 404 (-3.9A)
IOD  A 404 ( 4.8A)
None
0.40A 3u5kA-5n15A:
18.6
3u5kA-5n15A:
35.97
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5n15 BROMODOMAIN-CONTAINI
NG FACTOR 1


(Candida
albicans)
PF00439
(Bromodomain)
4 PRO A 233
VAL A 238
LEU A 243
MET A 300
IOD  A 405 ( 4.4A)
None
None
None
0.53A 3u5kA-5n15A:
18.6
3u5kA-5n15A:
35.97
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.
5nn8 LYSOSOMAL
ALPHA-GLUCOSIDASE


(Homo sapiens)
no annotation 4 VAL A 939
LEU A 941
LEU A 901
ILE A 885
CSO  A 938 ( 2.8A)
None
None
None
0.90A 3u5kA-5nn8A:
undetectable
3u5kA-5nn8A:
9.28
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.
5nxk SERINE-RICH SECRETED
CELL WALL ANCHORED
(LPXTG-MOTIF )
PROTEIN


(Lactobacillus
reuteri)
no annotation 4 VAL A 534
LEU A 536
LEU A 562
ILE A 526
None
0.90A 3u5kA-5nxkA:
undetectable
3u5kA-5nxkA:
22.90
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.
5ot1 PULLULANASE TYPE II,
GH13 FAMILY


(Thermococcus
kodakarensis)
no annotation 4 TRP A 492
VAL A 415
LEU A 405
ILE A 374
None
0.83A 3u5kA-5ot1A:
undetectable
3u5kA-5ot1A:
17.16
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5tpx HISTONE
ACETYLTRANSFERASE
GCN5


(Plasmodium
falciparum)
PF00439
(Bromodomain)
4 TRP A1379
PRO A1380
VAL A1385
ASN A1436
None
None
7H7  A1505 (-4.0A)
7H7  A1505 (-3.1A)
0.67A 3u5kA-5tpxA:
15.9
3u5kA-5tpxA:
30.95
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 7 TRP A 370
PRO A 371
VAL A 376
LEU A 381
LEU A 383
ASN A 429
MET A 438
None
7WY  A 501 (-4.4A)
7WY  A 501 ( 4.5A)
7WY  A 501 (-4.9A)
None
7WY  A 501 (-3.4A)
7WY  A 501 ( 3.9A)
0.41A 3u5kA-5u6vA:
18.0
3u5kA-5u6vA:
40.62
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.
5u7g CREB-BINDING PROTEIN

(Mus musculus)
PF00439
(Bromodomain)
PF00569
(ZZ)
PF06001
(DUF902)
PF08214
(HAT_KAT11)
4 PRO A1111
VAL A1116
LEU A1121
ASN A1169
None
0.56A 3u5kA-5u7gA:
16.6
3u5kA-5u7gA:
12.76
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.
5u9n BROMO DOMAIN
CONTAINING PROTEIN


(Cryptosporidium
parvum)
PF00439
(Bromodomain)
4 VAL A 332
LEU A 338
ASN A 413
ILE A 422
BMF  A 501 (-4.2A)
BMF  A 501 ( 4.9A)
BMF  A 501 (-2.8A)
BMF  A 501 ( 4.4A)
0.77A 3u5kA-5u9nA:
14.3
3u5kA-5u9nA:
23.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5usx THIOREDOXIN
REDUCTASE


(Vibrio
vulnificus)
PF07992
(Pyr_redox_2)
4 PRO A  54
VAL A  50
LEU A  65
ILE A 296
None
FAD  A 402 (-3.4A)
None
None
0.91A 3u5kA-5usxA:
undetectable
3u5kA-5usxA:
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.
5v84 CAT EYE SYNDROME
CRITICAL REGION
PROTEIN 2


(Homo sapiens)
PF00439
(Bromodomain)
5 TRP A 457
PRO A 458
VAL A 463
ASN A 514
MET A 523
None
96V  A 602 (-4.5A)
96V  A 602 (-3.9A)
96V  A 602 (-2.6A)
None
0.28A 3u5kA-5v84A:
16.6
3u5kA-5v84A:
28.87
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 8 TRP A  50
PRO A  51
VAL A  56
LEU A  61
LEU A  63
ASN A 109
ILE A 115
MET A 118
CL  A 208 (-4.9A)
IBI  A 201 (-4.3A)
IBI  A 201 ( 4.6A)
IBI  A 201 (-4.2A)
IBI  A 201 (-4.9A)
IBI  A 201 (-3.3A)
IBI  A 201 ( 3.8A)
None
0.49A 3u5kA-5vbrA:
19.3
3u5kA-5vbrA:
68.18
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.
5w4c THIOREDOXIN
REDUCTASE


(Cryptococcus
neoformans)
no annotation 4 PRO A  83
VAL A  79
LEU A  73
ILE A 326
None
FAD  A 401 ( 3.8A)
FAD  A 401 (-3.9A)
None
0.89A 3u5kA-5w4cA:
undetectable
3u5kA-5w4cA:
19.70
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.
5zln TOLL-LIKE RECEPTOR 9

(Mus musculus)
no annotation 4 VAL A 420
LEU A 398
LEU A 422
ILE A 410
None
0.82A 3u5kA-5zlnA:
undetectable
3u5kA-5zlnA:
19.69
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.
5zvs VP2

(Aquareovirus C)
no annotation 4 PRO 2 183
LEU 2 160
LEU 2 157
ILE 2  52
None
0.87A 3u5kA-5zvs2:
undetectable
3u5kA-5zvs2:
17.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6bvp 3-HYDROXYANTHRANILAT
E 3,4-DIOXYGENASE


(Cupriavidus
metallidurans)
no annotation 4 TRP A  31
VAL A  40
LEU A 107
LEU A  62
None
0.80A 3u5kA-6bvpA:
undetectable
3u5kA-6bvpA:
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.
6cw0 CGD2_2690 PROTEIN

(Cryptosporidium
parvum)
no annotation 4 VAL A  30
LEU A  35
LEU A  37
ASN A  83
R78  A 201 (-4.5A)
R78  A 201 (-4.9A)
None
R78  A 201 (-3.3A)
0.54A 3u5kA-6cw0A:
16.7
3u5kA-6cw0A:
26.83
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.
6dne BROMODOMAIN-CONTAINI
NG PROTEIN 4


(Homo sapiens)
no annotation 8 TRP A  81
PRO A  82
VAL A  87
LEU A  92
LEU A  94
ASN A 140
ILE A 146
MET A 149
None
H1V  A 501 (-4.6A)
H1V  A 501 ( 4.4A)
H1V  A 501 (-4.2A)
H1V  A 501 (-4.7A)
H1V  A 501 (-3.2A)
H1V  A 501 (-3.8A)
H1V  A 501 ( 3.8A)
0.36A 3u5kA-6dneA:
24.0
3u5kA-6dneA:
undetectable