SIMILAR PATTERNS OF AMINO ACIDS FOR 3S56_B_ROCB203

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.
1b2p PROTEIN (LECTIN)

(Hyacinthoides
hispanica)
PF01453
(B_lectin)
4 LEU A  73
LEU A  97
PRO A  14
ILE A   4
None
0.87A 3s56B-1b2pA:
undetectable
3s56B-1b2pA:
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.
1cuk RUVA PROTEIN

(Escherichia
coli)
PF01330
(RuvA_N)
PF07499
(RuvA_C)
PF14520
(HHH_5)
4 LEU A 124
LEU A 110
PRO A 114
ILE A 116
None
0.95A 3s56B-1cukA:
undetectable
3s56B-1cukA:
18.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1d1u PROTEIN (REVERSE
TRANSCRIPTASE)


(Murine leukemia
virus)
PF00078
(RVT_1)
4 LEU A 188
LEU A  48
PRO A  51
ILE A  50
None
0.94A 3s56B-1d1uA:
0.0
3s56B-1d1uA:
15.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1dcp DCOH

(Rattus
norvegicus)
PF01329
(Pterin_4a)
4 LEU A  77
LEU A  92
GLU A  97
ILE A  96
None
0.97A 3s56B-1dcpA:
undetectable
3s56B-1dcpA:
21.19
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.
1dq3 ENDONUCLEASE

(Pyrococcus
furiosus)
PF09061
(Stirrup)
PF09062
(Endonuc_subdom)
PF14528
(LAGLIDADG_3)
PF14890
(Intein_splicing)
4 GLU A 399
LEU A 397
GLU A 372
ILE A 369
None
0.96A 3s56B-1dq3A:
0.0
3s56B-1dq3A:
12.56
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.
1e5d RUBREDOXIN:OXYGEN
OXIDOREDUCTASE


(Desulfovibrio
gigas)
PF00258
(Flavodoxin_1)
PF00753
(Lactamase_B)
4 LEU A  39
GLU A  41
LEU A  47
ILE A  72
None
0.88A 3s56B-1e5dA:
0.0
3s56B-1e5dA:
13.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1em8 DNA POLYMERASE III
PSI SUBUNIT


(Escherichia
coli)
PF03603
(DNA_III_psi)
4 LEU B  98
LEU B  79
PRO B  34
ILE B  33
None
0.70A 3s56B-1em8B:
undetectable
3s56B-1em8B:
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.
1fft UBIQUINOL OXIDASE

(Escherichia
coli)
PF00116
(COX2)
PF06481
(COX_ARM)
4 LEU B 114
GLU B 115
LEU B 193
ILE B 183
None
0.80A 3s56B-1fftB:
0.0
3s56B-1fftB:
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.
1g59 GLUTAMYL-TRNA
SYNTHETASE


(Thermus
thermophilus)
PF00749
(tRNA-synt_1c)
4 LEU A  60
LEU A  57
PRO A  10
ILE A  56
None
0.95A 3s56B-1g59A:
undetectable
3s56B-1g59A:
14.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1hvc HIV-1 PROTEASE

(Human
immunodeficiency
virus 1)
PF00077
(RVP)
6 ARG A   8
LEU A  10
GLU A  21
LEU A  23
GLU A  34
PRO A  81
A79  A 800 (-3.6A)
None
None
A79  A 800 ( 4.0A)
None
A79  A 800 ( 3.4A)
0.69A 3s56B-1hvcA:
14.1
3s56B-1hvcA:
45.32
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1hvc HIV-1 PROTEASE

(Human
immunodeficiency
virus 1)
PF00077
(RVP)
5 ARG A   8
LEU A  10
GLU A  21
LEU A  23
PRO A  81
A79  A 800 (-3.4A)
None
None
A79  A 800 ( 3.8A)
A79  A 800 ( 3.9A)
0.72A 3s56B-1hvcA:
14.1
3s56B-1hvcA:
45.32
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1hvc HIV-1 PROTEASE

(Human
immunodeficiency
virus 1)
PF00077
(RVP)
5 LEU A  10
GLU A  21
LEU A  23
GLU A  34
PRO A  81
None
None
A79  A 800 ( 3.8A)
None
A79  A 800 ( 3.9A)
0.80A 3s56B-1hvcA:
14.1
3s56B-1hvcA:
45.32
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.
1iom CITRATE SYNTHASE

(Thermus
thermophilus)
PF00285
(Citrate_synt)
4 LEU A  55
GLU A  45
PRO A  33
ILE A  32
None
0.95A 3s56B-1iomA:
undetectable
3s56B-1iomA:
12.50
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.
1jed SULFATE
ADENYLYLTRANSFERASE


(Saccharomyces
cerevisiae)
PF01747
(ATP-sulfurylase)
PF14306
(PUA_2)
4 LEU A 365
LEU A 361
GLU A 370
ILE A 371
None
0.97A 3s56B-1jedA:
undetectable
3s56B-1jedA:
12.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ldk CULLIN HOMOLOG

(Homo sapiens)
PF00888
(Cullin)
PF10557
(Cullin_Nedd8)
4 LEU B 644
LEU B 649
GLU B 652
ILE B 669
None
0.84A 3s56B-1ldkB:
undetectable
3s56B-1ldkB:
14.16
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.
1ljo ARCHAEAL SM-LIKE
PROTEIN AF-SM2


(Archaeoglobus
fulgidus)
PF01423
(LSM)
4 LEU A  42
LEU A  33
PRO A  74
ILE A  18
None
0.92A 3s56B-1ljoA:
undetectable
3s56B-1ljoA:
23.58
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.
1ljo ARCHAEAL SM-LIKE
PROTEIN AF-SM2


(Archaeoglobus
fulgidus)
PF01423
(LSM)
4 LEU A  44
LEU A  33
PRO A  74
ILE A  18
None
0.80A 3s56B-1ljoA:
undetectable
3s56B-1ljoA:
23.58
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.
1neq DNA-BINDING PROTEIN
NER


(Escherichia
virus Mu)
PF13693
(HTH_35)
4 LEU A  25
LEU A  28
GLU A  51
ILE A  54
None
0.87A 3s56B-1neqA:
undetectable
3s56B-1neqA:
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.
1nzj HYPOTHETICAL PROTEIN
YADB


(Escherichia
coli)
PF00749
(tRNA-synt_1c)
4 LEU A  64
LEU A  61
PRO A  14
ILE A  60
None
0.92A 3s56B-1nzjA:
undetectable
3s56B-1nzjA:
18.18
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.
1ofh ATP-DEPENDENT HSL
PROTEASE ATP-BINDING
SUBUNIT HSLU


(Haemophilus
influenzae)
PF07724
(AAA_2)
PF10431
(ClpB_D2-small)
5 LEU A  73
LEU A  13
GLU A   8
PRO A   6
ILE A   9
None
1.27A 3s56B-1ofhA:
undetectable
3s56B-1ofhA:
17.76
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.
1ogq POLYGALACTURONASE
INHIBITING PROTEIN


(Phaseolus
vulgaris)
PF08263
(LRRNT_2)
4 LEU A 204
LEU A 186
PRO A 166
ILE A 165
None
0.95A 3s56B-1ogqA:
undetectable
3s56B-1ogqA:
15.75
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.
1oul STRINGENT STARVATION
PROTEIN B HOMOLOG


(Haemophilus
influenzae)
PF04386
(SspB)
4 LEU A  52
LEU A  82
PRO A  85
ILE A  84
None
0.93A 3s56B-1oulA:
undetectable
3s56B-1oulA:
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.
1puj CONSERVED
HYPOTHETICAL PROTEIN
YLQF


(Bacillus
subtilis)
PF01926
(MMR_HSR1)
4 LEU A  21
LEU A 124
GLU A  29
ILE A 126
None
0.96A 3s56B-1pujA:
undetectable
3s56B-1pujA:
20.80
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.
1qcx PECTIN LYASE B

(Aspergillus
niger)
PF00544
(Pec_lyase_C)
4 LEU A  31
LEU A  35
PRO A 103
ILE A 104
None
0.91A 3s56B-1qcxA:
undetectable
3s56B-1qcxA:
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.
1qor QUINONE
OXIDOREDUCTASE


(Escherichia
coli)
PF00107
(ADH_zinc_N)
PF08240
(ADH_N)
4 GLU A 298
LEU A 324
PRO A 327
ILE A 326
None
0.90A 3s56B-1qorA:
undetectable
3s56B-1qorA:
14.20
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.
1qvr CLPB PROTEIN

(Thermus
thermophilus)
PF00004
(AAA)
PF02861
(Clp_N)
PF07724
(AAA_2)
PF10431
(ClpB_D2-small)
4 LEU A 592
LEU A 706
GLU A 668
ILE A 669
None
0.92A 3s56B-1qvrA:
undetectable
3s56B-1qvrA:
7.80
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.
1rq8 CONSERVED
HYPOTHETICAL PROTEIN


(Staphylococcus
aureus)
PF01985
(CRS1_YhbY)
4 LEU A  10
LEU A  95
GLU A  92
ILE A  93
None
0.96A 3s56B-1rq8A:
undetectable
3s56B-1rq8A:
19.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ru0 DCOH-LIKE PROTEIN
DCOHM


(Mus musculus)
PF01329
(Pterin_4a)
4 LEU A  77
LEU A  92
GLU A  97
ILE A  96
None
0.86A 3s56B-1ru0A:
undetectable
3s56B-1ru0A:
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.
1s3i 10-FORMYLTETRAHYDROF
OLATE DEHYDROGENASE


(Rattus
norvegicus)
PF00551
(Formyl_trans_N)
PF02911
(Formyl_trans_C)
4 LEU A 277
LEU A 261
PRO A 264
ILE A 263
None
0.91A 3s56B-1s3iA:
undetectable
3s56B-1s3iA:
16.50
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1siv SIV PROTEASE

(Simian
immunodeficiency
virus)
PF00077
(RVP)
4 ARG A   8
GLU A  21
LEU A  23
PRO A  81
None
0.84A 3s56B-1sivA:
17.8
3s56B-1sivA:
53.54
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.
1sum PHOSPHATE TRANSPORT
SYSTEM PROTEIN PHOU
HOMOLOG 2


(Thermotoga
maritima)
PF01895
(PhoU)
4 LEU B 166
LEU B 183
PRO B 120
ILE B 119
None
0.89A 3s56B-1sumB:
undetectable
3s56B-1sumB:
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.
1tjr BX1

(Zea mays)
PF00290
(Trp_syntA)
4 LEU A 195
GLU A 222
PRO A 189
ILE A 190
None
0.86A 3s56B-1tjrA:
undetectable
3s56B-1tjrA:
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.
1u1h 5-METHYLTETRAHYDROPT
EROYLTRIGLUTAMATE--H
OMOCYSTEINE
METHYLTRANSFERASE


(Arabidopsis
thaliana)
PF01717
(Meth_synt_2)
PF08267
(Meth_synt_1)
4 LEU A 233
LEU A 236
PRO A 153
ILE A 203
None
0.96A 3s56B-1u1hA:
undetectable
3s56B-1u1hA:
8.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ueb ELONGATION FACTOR P

(Thermus
thermophilus)
PF01132
(EFP)
PF08207
(EFP_N)
PF09285
(Elong-fact-P_C)
4 LEU A  44
GLU A  21
LEU A  19
ILE A  63
None
0.95A 3s56B-1uebA:
undetectable
3s56B-1uebA:
20.96
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.
1v26 LONG-CHAIN-FATTY-ACI
D-COA SYNTHETASE


(Thermus
thermophilus)
PF00501
(AMP-binding)
PF13193
(AMP-binding_C)
4 GLU A 328
LEU A 388
PRO A 391
ILE A 393
MG  A3001 (-3.0A)
None
None
None
0.87A 3s56B-1v26A:
undetectable
3s56B-1v26A:
11.34
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.
1vlv ORNITHINE
CARBAMOYLTRANSFERASE


(Thermotoga
maritima)
PF00185
(OTCace)
PF02729
(OTCace_N)
5 LEU A 140
LEU A  25
GLU A  20
PRO A  18
ILE A  21
None
1.22A 3s56B-1vlvA:
undetectable
3s56B-1vlvA:
14.15
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.
1vp6 CYCLIC-NUCLEOTIDE
BINDING DOMAIN OF
MESORHIZOBIUM LOTI
CNG POTASSIUM
CHANNEL


(Mesorhizobium
loti)
PF00027
(cNMP_binding)
4 LEU A 322
LEU A 251
GLU A 246
ILE A 247
None
0.80A 3s56B-1vp6A:
undetectable
3s56B-1vp6A:
24.11
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.
1woy METHIONYL-TRNA
SYNTHETASE


(Thermus
thermophilus)
PF00133
(tRNA-synt_1)
PF09334
(tRNA-synt_1g)
4 LEU A 469
LEU A 467
PRO A 373
ILE A 372
None
0.96A 3s56B-1woyA:
undetectable
3s56B-1woyA:
10.86
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.
1wyt GLYCINE
DEHYDROGENASE
SUBUNIT 2
(P-PROTEIN)


(Thermus
thermophilus)
PF02347
(GDC-P)
4 LEU B 207
LEU B 160
PRO B 184
ILE B 183
None
0.90A 3s56B-1wytB:
undetectable
3s56B-1wytB:
12.39
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.
1xtp LMAJ004091AAA

(Leishmania
major)
PF05891
(Methyltransf_PK)
4 ARG A  83
LEU A 111
LEU A 115
ILE A  86
None
0.83A 3s56B-1xtpA:
undetectable
3s56B-1xtpA:
22.65
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.
1y0h HYPOTHETICAL PROTEIN
RV0793


(Mycobacterium
tuberculosis)
PF03992
(ABM)
4 LEU A  55
GLU A  57
LEU A  44
ILE A  30
None
ACT  A 301 (-2.9A)
None
None
0.80A 3s56B-1y0hA:
undetectable
3s56B-1y0hA:
19.81
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.
1y51 PHOSPHOCARRIER
PROTEIN HPR


(Geobacillus
stearothermophilus)
PF00381
(PTS-HPr)
4 LEU A  35
LEU A  53
PRO A  56
ILE A  55
None
0.81A 3s56B-1y51A:
undetectable
3s56B-1y51A:
25.22
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.
1y8p [PYRUVATE
DEHYDROGENASE
[LIPOAMIDE]] KINASE
ISOZYME 3


(Homo sapiens)
PF02518
(HATPase_c)
PF10436
(BCDHK_Adom3)
4 LEU A 281
LEU A 276
PRO A 231
ILE A 232
None
0.89A 3s56B-1y8pA:
undetectable
3s56B-1y8pA:
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.
1z6t APOPTOTIC PROTEASE
ACTIVATING FACTOR 1


(Homo sapiens)
PF00619
(CARD)
PF00931
(NB-ARC)
4 LEU A 566
LEU A 554
GLU A 515
PRO A 559
None
0.92A 3s56B-1z6tA:
undetectable
3s56B-1z6tA:
10.83
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.
1zkp HYPOTHETICAL PROTEIN
BA1088


(Bacillus
anthracis)
PF12706
(Lactamase_B_2)
4 LEU A  23
GLU A  25
LEU A  32
ILE A  52
None
0.81A 3s56B-1zkpA:
undetectable
3s56B-1zkpA:
15.67
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.
2acv TRITERPENE
UDP-GLUCOSYL
TRANSFERASE UGT71G1


(Medicago
truncatula)
PF00201
(UDPGT)
4 LEU A 188
LEU A 174
PRO A 177
ILE A 176
None
0.87A 3s56B-2acvA:
undetectable
3s56B-2acvA:
15.84
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.
2aj2 HYPOTHETICAL UPF0301
PROTEIN VC0467


(Vibrio cholerae)
PF02622
(DUF179)
4 LEU A 128
GLU A 133
LEU A 125
ILE A 124
None
0.90A 3s56B-2aj2A:
undetectable
3s56B-2aj2A:
23.39
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.
2am4 ALPHA-1,3-MANNOSYL-G
LYCOPROTEIN
2-BETA-N-ACETYLGLUCO
SAMINYLTRANSFERASE


(Oryctolagus
cuniculus)
PF03071
(GNT-I)
4 LEU A 124
LEU A 127
PRO A 138
ILE A 139
None
None
GOL  A 450 ( 4.9A)
GOL  A 450 (-4.4A)
0.94A 3s56B-2am4A:
undetectable
3s56B-2am4A:
16.03
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.
2b4z CYTOCHROME C

(Bos taurus)
PF00034
(Cytochrom_C)
4 GLU A  62
LEU A  64
GLU A  92
ILE A  95
None
0.89A 3s56B-2b4zA:
undetectable
3s56B-2b4zA:
23.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2b81 LUCIFERASE-LIKE
MONOOXYGENASE


(Bacillus cereus)
PF00296
(Bac_luciferase)
4 LEU A 252
LEU A 276
GLU A 260
PRO A 258
None
0.96A 3s56B-2b81A:
undetectable
3s56B-2b81A:
15.12
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.
2cda GLUCOSE
DEHYDROGENASE


(Sulfolobus
solfataricus)
PF08240
(ADH_N)
PF16912
(Glu_dehyd_C)
4 LEU A 148
LEU A 334
GLU A 358
ILE A 359
None
0.91A 3s56B-2cdaA:
undetectable
3s56B-2cdaA:
16.33
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.
2ch1 3-HYDROXYKYNURENINE
TRANSAMINASE


(Anopheles
gambiae)
PF00266
(Aminotran_5)
4 LEU A 132
GLU A 133
GLU A 140
ILE A 168
None
0.81A 3s56B-2ch1A:
undetectable
3s56B-2ch1A:
14.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2cyc TYROSYL-TRNA
SYNTHETASE


(Pyrococcus
horikoshii)
PF00579
(tRNA-synt_1b)
5 LEU A  48
LEU A 347
GLU A 269
PRO A 267
ILE A 270
None
1.42A 3s56B-2cycA:
undetectable
3s56B-2cycA:
14.13
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.
2d1h 109AA LONG
HYPOTHETICAL
TRANSCRIPTIONAL
REGULATOR


(Sulfurisphaera
tokodaii)
PF01978
(TrmB)
4 LEU A  28
GLU A   7
GLU A  12
ILE A  13
None
0.96A 3s56B-2d1hA:
undetectable
3s56B-2d1hA:
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.
2d4n DU

(Mason-Pfizer
monkey virus)
PF00692
(dUTPase)
4 LEU A 208
LEU A 123
PRO A 109
ILE A 110
None
0.90A 3s56B-2d4nA:
undetectable
3s56B-2d4nA:
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.
2dfe RIBONUCLEASE HII

(Thermococcus
kodakarensis)
PF01351
(RNase_HII)
4 LEU A  80
GLU A  84
PRO A  70
ILE A  73
None
0.76A 3s56B-2dfeA:
undetectable
3s56B-2dfeA:
16.51
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.
2dg8 PUTATIVE TETR-FAMILY
TRANSCRIPTIONAL
REGULATORY PROTEIN


(Streptomyces
coelicolor)
PF00440
(TetR_N)
4 LEU A 135
LEU A 147
GLU A 152
ILE A 151
None
0.78A 3s56B-2dg8A:
undetectable
3s56B-2dg8A:
20.99
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.
2dou PROBABLE
N-SUCCINYLDIAMINOPIM
ELATE
AMINOTRANSFERASE


(Thermus
thermophilus)
PF00155
(Aminotran_1_2)
4 LEU A 162
LEU A 115
PRO A 139
ILE A 138
None
0.73A 3s56B-2douA:
undetectable
3s56B-2douA:
13.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2e7c MYOSIN-BINDING
PROTEIN C, FAST-TYPE


(Homo sapiens)
PF07679
(I-set)
4 LEU A  26
LEU A  30
GLU A  93
ILE A 109
None
0.81A 3s56B-2e7cA:
undetectable
3s56B-2e7cA:
24.19
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.
2ec1 NUCLEOPORIN 50 KDA

(Homo sapiens)
PF00638
(Ran_BP1)
4 LEU A  40
LEU A  50
PRO A  68
ILE A  67
None
0.89A 3s56B-2ec1A:
undetectable
3s56B-2ec1A:
16.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ejv L-THREONINE
3-DEHYDROGENASE


(Thermus
thermophilus)
PF00107
(ADH_zinc_N)
PF08240
(ADH_N)
4 LEU A 249
GLU A 275
LEU A 252
ILE A 281
None
0.77A 3s56B-2ejvA:
undetectable
3s56B-2ejvA:
14.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2fff PENICILLIN-BINDING
PROTEIN 1B


(Streptococcus
pneumoniae)
PF00905
(Transpeptidase)
4 LEU B 466
GLU B 540
PRO B 547
ILE B 546
None
0.89A 3s56B-2fffB:
undetectable
3s56B-2fffB:
16.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2fja ADENYLYLSULFATE
REDUCTASE, SUBUNIT A


(Archaeoglobus
fulgidus)
PF00890
(FAD_binding_2)
PF02910
(Succ_DH_flav_C)
4 LEU A 128
GLU A 159
PRO A 155
ILE A 156
None
0.87A 3s56B-2fjaA:
undetectable
3s56B-2fjaA:
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.
2fna CONSERVED
HYPOTHETICAL PROTEIN


(Sulfolobus
solfataricus)
PF01637
(ATPase_2)
4 LEU A 328
LEU A 331
PRO A 346
ILE A 337
None
0.87A 3s56B-2fnaA:
undetectable
3s56B-2fnaA:
16.33
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.
2gfp MULTIDRUG RESISTANCE
PROTEIN D


(Escherichia
coli)
PF07690
(MFS_1)
4 ARG A  72
LEU A  16
LEU A  77
ILE A  76
None
0.89A 3s56B-2gfpA:
undetectable
3s56B-2gfpA:
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.
2gnp TRANSCRIPTIONAL
REGULATOR


(Streptococcus
pneumoniae)
PF04198
(Sugar-bind)
5 LEU A 267
GLU A 253
LEU A 297
GLU A 241
ILE A 242
None
1.46A 3s56B-2gnpA:
undetectable
3s56B-2gnpA:
18.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2h5g DELTA
1-PYRROLINE-5-CARBOX
YLATE SYNTHETASE


(Homo sapiens)
PF00171
(Aldedh)
4 LEU A 757
LEU A 554
PRO A 557
ILE A 556
None
0.94A 3s56B-2h5gA:
undetectable
3s56B-2h5gA:
13.24
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.
2hey TUMOR NECROSIS
FACTOR LIGAND
SUPERFAMILY MEMBER 4


(Mus musculus)
no annotation 4 LEU F 154
LEU F 118
PRO F 130
ILE F 129
None
0.85A 3s56B-2heyF:
undetectable
3s56B-2heyF:
19.01
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.
2hpa PROTEIN (ACID
PHOSPHATASE)


(Homo sapiens)
PF00328
(His_Phos_2)
4 ARG A1300
LEU A1283
GLU A1285
ILE A1053
None
0.89A 3s56B-2hpaA:
undetectable
3s56B-2hpaA:
14.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2i4s GENERAL SECRETION
PATHWAY PROTEIN C


(Vibrio cholerae)
no annotation 4 ARG A 211
LEU A 249
GLU A 220
ILE A 214
None
0.89A 3s56B-2i4sA:
undetectable
3s56B-2i4sA:
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.
2jkd PRE-MRNA LEAKAGE
PROTEIN 1


(Saccharomyces
cerevisiae)
PF00498
(FHA)
4 LEU A 186
LEU A 167
PRO A 173
ILE A 172
None
0.75A 3s56B-2jkdA:
undetectable
3s56B-2jkdA:
23.38
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.
2nyf NOSTOC PUNCTIFORME
PHENYLALANINE
AMMONIA LYASE


(Nostoc
punctiforme)
PF00221
(Lyase_aromatic)
4 ARG A 146
LEU A 143
GLU A 217
ILE A 182
None
0.90A 3s56B-2nyfA:
undetectable
3s56B-2nyfA:
11.62
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.
2oaj PROTEIN SNI1

(Saccharomyces
cerevisiae)
PF08596
(Lgl_C)
4 LEU A 830
LEU A 836
PRO A 853
ILE A 852
None
0.94A 3s56B-2oajA:
undetectable
3s56B-2oajA:
7.66
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.
2oo3 PROTEIN INVOLVED IN
CATABOLISM OF
EXTERNAL DNA


(Legionella
pneumophila)
PF04378
(RsmJ)
4 LEU A 256
GLU A 251
PRO A 249
ILE A 252
None
0.82A 3s56B-2oo3A:
undetectable
3s56B-2oo3A:
16.37
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.
2p2w CITRATE SYNTHASE

(Thermotoga
maritima)
PF00285
(Citrate_synt)
4 LEU A  54
GLU A  44
PRO A  32
ILE A  31
None
0.86A 3s56B-2p2wA:
undetectable
3s56B-2p2wA:
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.
2plc PHOSPHATIDYLINOSITOL
-SPECIFIC
PHOSPHOLIPASE C


(Listeria
monocytogenes)
PF00388
(PI-PLC-X)
4 LEU A  36
LEU A  39
PRO A  42
ILE A  41
None
0.70A 3s56B-2plcA:
undetectable
3s56B-2plcA:
16.30
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.
2q8h [PYRUVATE
DEHYDROGENASE
[LIPOAMIDE]] KINASE
ISOZYME 1


(Homo sapiens)
PF02518
(HATPase_c)
PF10436
(BCDHK_Adom3)
4 LEU A 312
LEU A 307
PRO A 263
ILE A 264
None
0.96A 3s56B-2q8hA:
undetectable
3s56B-2q8hA:
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.
2q8n GLUCOSE-6-PHOSPHATE
ISOMERASE


(Thermotoga
maritima)
PF00342
(PGI)
4 LEU A 358
LEU A 355
PRO A 340
ILE A 339
None
0.91A 3s56B-2q8nA:
undetectable
3s56B-2q8nA:
12.21
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2rkf PROTEASE RETROPEPSIN

(Human
immunodeficiency
virus 1)
PF00077
(RVP)
5 ARG A   8
GLU A  21
LEU A  23
GLU A  34
PRO A  81
AB1  A 501 ( 4.7A)
None
None
None
AB1  A 501 (-4.2A)
0.80A 3s56B-2rkfA:
20.3
3s56B-2rkfA:
84.85
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.
2vzx GREEN FLUORESCENT
PROTEIN


(Dendronephthya
sp. SSAL-2002)
PF01353
(GFP)
4 LEU A 162
GLU A 140
LEU A 137
GLU A 196
None
0.93A 3s56B-2vzxA:
undetectable
3s56B-2vzxA:
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.
2x0s PYRUVATE PHOSPHATE
DIKINASE


(Trypanosoma
brucei)
PF00391
(PEP-utilizers)
PF01326
(PPDK_N)
PF02896
(PEP-utilizers_C)
4 GLU A  33
LEU A 339
PRO A  40
ILE A  39
None
0.94A 3s56B-2x0sA:
undetectable
3s56B-2x0sA:
8.68
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.
2yyo SPRY
DOMAIN-CONTAINING
PROTEIN 3


(Homo sapiens)
PF00622
(SPRY)
4 LEU A  60
LEU A  36
PRO A 113
ILE A 111
None
0.83A 3s56B-2yyoA:
undetectable
3s56B-2yyoA:
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.
2zj8 PUTATIVE SKI2-TYPE
HELICASE


(Pyrococcus
furiosus)
PF00270
(DEAD)
PF00271
(Helicase_C)
PF14520
(HHH_5)
4 LEU A 460
LEU A 463
PRO A 479
ILE A 469
None
0.96A 3s56B-2zj8A:
undetectable
3s56B-2zj8A:
9.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2zkj [PYRUVATE
DEHYDROGENASE
[LIPOAMIDE]] KINASE
ISOZYME 4


(Homo sapiens)
PF02518
(HATPase_c)
PF10436
(BCDHK_Adom3)
4 LEU A 287
LEU A 282
PRO A 238
ILE A 239
None
0.90A 3s56B-2zkjA:
undetectable
3s56B-2zkjA:
13.54
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.
3a98 ENGULFMENT AND CELL
MOTILITY PROTEIN 1


(Homo sapiens)
PF16457
(PH_12)
4 LEU B 698
LEU B 701
PRO B 707
ILE B 706
None
0.78A 3s56B-3a98B:
undetectable
3s56B-3a98B:
21.62
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.
3abz BETA-GLUCOSIDASE I

(Kluyveromyces
marxianus)
PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C)
PF07691
(PA14)
PF14310
(Fn3-like)
5 LEU A  13
GLU A  17
LEU A   9
PRO A  39
ILE A  38
None
1.45A 3s56B-3abzA:
undetectable
3s56B-3abzA:
9.22
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.
3aex THREONINE SYNTHASE

(Thermus
thermophilus)
PF00291
(PALP)
4 LEU A 301
GLU A  39
LEU A 306
ILE A  45
None
0.83A 3s56B-3aexA:
undetectable
3s56B-3aexA:
14.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ahm OLIGOPEPTIDASE

(Geobacillus sp.
MO-1)
no annotation 4 LEU A 264
GLU A 269
PRO A 274
ILE A 259
None
0.95A 3s56B-3ahmA:
undetectable
3s56B-3ahmA:
11.70
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.
3apm PROTEIN-ARGININE
DEIMINASE TYPE-4


(Homo sapiens)
PF03068
(PAD)
PF08526
(PAD_N)
PF08527
(PAD_M)
4 LEU A 620
LEU A 596
PRO A 599
ILE A 598
None
0.81A 3s56B-3apmA:
undetectable
3s56B-3apmA:
10.14
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.
3bh1 UPF0371 PROTEIN
DIP2346


(Corynebacterium
diphtheriae)
PF08903
(DUF1846)
5 LEU A 427
LEU A 379
GLU A 410
PRO A 406
ILE A 409
None
1.43A 3s56B-3bh1A:
undetectable
3s56B-3bh1A:
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.
3bjr PUTATIVE
CARBOXYLESTERASE


(Lactobacillus
plantarum)
PF07859
(Abhydrolase_3)
4 LEU A  15
LEU A  67
PRO A 109
ILE A  35
None
0.72A 3s56B-3bjrA:
undetectable
3s56B-3bjrA:
12.63
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.
3c7j TRANSCRIPTIONAL
REGULATOR, GNTR
FAMILY


(Pseudomonas
syringae group
genomosp. 3)
PF00392
(GntR)
PF07729
(FCD)
4 ARG A  33
LEU A  70
LEU A  75
ILE A  36
None
0.93A 3s56B-3c7jA:
undetectable
3s56B-3c7jA:
14.77
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.
3ciy TOLL-LIKE RECEPTOR 3

(Mus musculus)
PF00560
(LRR_1)
PF13855
(LRR_8)
4 LEU A 617
LEU A 598
PRO A 578
ILE A 577
None
0.95A 3s56B-3ciyA:
undetectable
3s56B-3ciyA:
8.61
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.
3dz1 DIHYDRODIPICOLINATE
SYNTHASE


(Rhodopseudomonas
palustris)
PF00701
(DHDPS)
4 LEU A 137
LEU A 166
PRO A 150
ILE A 153
None
0.95A 3s56B-3dz1A:
undetectable
3s56B-3dz1A:
14.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3e20 EUKARYOTIC PEPTIDE
CHAIN RELEASE FACTOR
SUBUNIT 1


(Schizosaccharomyces
pombe)
no annotation 4 LEU C  79
LEU C  34
PRO C  37
ILE C  36
None
0.93A 3s56B-3e20C:
undetectable
3s56B-3e20C:
13.32
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.
3els PRE-MRNA LEAKAGE
PROTEIN 1


(Saccharomyces
cerevisiae)
PF00498
(FHA)
4 LEU A 186
LEU A 167
PRO A 173
ILE A 172
None
None
CL  A 205 ( 4.8A)
None
0.74A 3s56B-3elsA:
undetectable
3s56B-3elsA:
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.
3f2b DNA-DIRECTED DNA
POLYMERASE III ALPHA
CHAIN


(Geobacillus
kaustophilus)
PF02811
(PHP)
PF07733
(DNA_pol3_alpha)
PF14579
(HHH_6)
4 LEU A 623
LEU A 637
PRO A 653
ILE A 652
None
0.86A 3s56B-3f2bA:
undetectable
3s56B-3f2bA:
6.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3f2k HISTONE-LYSINE
N-METHYLTRANSFERASE
SETMAR


(Homo sapiens)
PF01359
(Transposase_1)
4 LEU A 152
GLU A 150
LEU A 128
ILE A  34
None
0.86A 3s56B-3f2kA:
undetectable
3s56B-3f2kA:
19.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3g8y SUSD/RAGB-ASSOCIATED
ESTERASE-LIKE
PROTEIN


(Bacteroides
vulgatus)
PF12715
(Abhydrolase_7)
4 LEU A 265
LEU A 141
PRO A 144
ILE A 143
None
0.89A 3s56B-3g8yA:
undetectable
3s56B-3g8yA:
13.02
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.
3ghf SEPTUM
SITE-DETERMINING
PROTEIN MINC


(Salmonella
enterica)
PF05209
(MinC_N)
4 LEU A  55
GLU A  22
LEU A  20
ILE A  28
CIT  A 201 (-3.6A)
CIT  A 201 (-2.8A)
None
None
0.82A 3s56B-3ghfA:
undetectable
3s56B-3ghfA:
20.97