SIMILAR PATTERNS OF AMINO ACIDS FOR 3TL9_A_ROCA401_2

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.
1akm ORNITHINE
TRANSCARBAMYLASE


(Escherichia
coli)
PF00185
(OTCace)
PF02729
(OTCace_N)
3 ARG A 246
VAL A 255
THR A 230
None
0.74A 3tl9A-1akmA:
0.0
3tl9A-1akmA:
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.
1bco BACTERIOPHAGE MU
TRANSPOSASE


(Escherichia
virus Mu)
PF02914
(DDE_2)
PF09299
(Mu-transpos_C)
3 ARG A 324
VAL A 467
THR A 297
None
0.81A 3tl9A-1bcoA:
0.0
3tl9A-1bcoA:
15.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1cg4 PROTEIN
(ADENYLOSUCCINATE
SYNTHETASE)


(Escherichia
coli)
PF00709
(Adenylsucc_synt)
3 ARG A 272
VAL A 313
THR A 358
None
0.85A 3tl9A-1cg4A:
0.0
3tl9A-1cg4A:
13.92
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.
1flg PROTEIN
(QUINOPROTEIN
ETHANOL
DEHYDROGENASE)


(Pseudomonas
aeruginosa)
PF01011
(PQQ)
PF13360
(PQQ_2)
3 ARG A 185
VAL A 303
THR A 218
None
0.83A 3tl9A-1flgA:
0.0
3tl9A-1flgA:
10.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1fml RETINOL DEHYDRATASE

(Spodoptera
frugiperda)
PF00685
(Sulfotransfer_1)
3 ARG A 185
VAL A  68
THR A  79
A3P  A 400 (-2.8A)
None
None
0.84A 3tl9A-1fmlA:
0.0
3tl9A-1fmlA:
13.18
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.
1fml RETINOL DEHYDRATASE

(Spodoptera
frugiperda)
PF00685
(Sulfotransfer_1)
3 ARG A 312
VAL A 293
THR A  77
A3P  A 400 (-3.7A)
None
A3P  A 400 (-3.6A)
0.79A 3tl9A-1fmlA:
0.0
3tl9A-1fmlA:
13.18
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.
1foh PHENOL HYDROXYLASE

(Cutaneotrichosporon
cutaneum)
PF01494
(FAD_binding_3)
PF07976
(Phe_hydrox_dim)
3 ARG A 394
VAL A 464
THR A 399
None
0.68A 3tl9A-1fohA:
0.0
3tl9A-1fohA:
9.93
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)
3 ARG A   8
VAL A  32
THR A  80
A79  A 800 (-3.4A)
A79  A 800 ( 4.4A)
None
0.41A 3tl9A-1hvcA:
14.0
3tl9A-1hvcA:
47.78
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)
3 ARG A   8
VAL A  32
THR A  80
A79  A 800 (-3.6A)
A79  A 800 ( 4.3A)
None
0.40A 3tl9A-1hvcA:
14.0
3tl9A-1hvcA:
47.78
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.
1iu9 ASPARTATE RACEMASE

(Pyrococcus
horikoshii)
PF01177
(Asp_Glu_race)
3 ARG A 172
VAL A 155
THR A 178
None
0.87A 3tl9A-1iu9A:
undetectable
3tl9A-1iu9A:
25.86
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.
1lar PROTEIN (LAR)

(Homo sapiens)
PF00102
(Y_phosphatase)
3 ARG A1505
VAL A1829
THR A1844
None
0.85A 3tl9A-1larA:
0.0
3tl9A-1larA:
10.09
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.
1m4i AMINOGLYCOSIDE
2'-N-ACETYLTRANSFERA
SE


(Mycobacterium
tuberculosis)
PF13527
(Acetyltransf_9)
3 ARG A 176
VAL A 147
THR A 149
None
0.88A 3tl9A-1m4iA:
undetectable
3tl9A-1m4iA:
20.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1mb9 BETA-LACTAM
SYNTHETASE


(Streptomyces
clavuligerus)
PF00733
(Asn_synthase)
PF13537
(GATase_7)
3 ARG A 120
VAL A  51
THR A  30
None
0.85A 3tl9A-1mb9A:
undetectable
3tl9A-1mb9A:
11.89
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.
1mlz 7,8-DIAMINO-PELARGON
IC ACID
AMINOTRANSFERASE


(Escherichia
coli)
PF00202
(Aminotran_3)
3 ARG A 221
VAL A 154
THR A 139
None
0.61A 3tl9A-1mlzA:
undetectable
3tl9A-1mlzA:
12.91
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.
1n9b BETA-LACTAMASE SHV-2

(Klebsiella
pneumoniae)
PF13354
(Beta-lactamase2)
3 ARG A 266
VAL A 247
THR A  71
None
0.57A 3tl9A-1n9bA:
undetectable
3tl9A-1n9bA:
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.
1ort ORNITHINE
TRANSCARBAMOYLASE


(Pseudomonas
aeruginosa)
PF00185
(OTCace)
PF02729
(OTCace_N)
3 ARG A 246
VAL A 255
THR A 230
None
0.65A 3tl9A-1ortA:
undetectable
3tl9A-1ortA:
13.47
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.
1ow0 IG ALPHA-1 CHAIN C
REGION


(Homo sapiens)
PF00047
(ig)
PF07654
(C1-set)
3 ARG A 401
VAL A 381
THR A 397
None
0.80A 3tl9A-1ow0A:
undetectable
3tl9A-1ow0A:
16.97
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.
1qge PROTEIN
(TRIACYLGLYCEROL
HYDROLASE)


(Burkholderia
glumae)
PF00561
(Abhydrolase_1)
no annotation
3 ARG D  94
VAL E 276
THR D 192
None
0.88A 3tl9A-1qgeD:
undetectable
3tl9A-1qgeD:
16.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1qlb FUMARATE REDUCTASE
FLAVOPROTEIN SUBUNIT


(Wolinella
succinogenes)
PF00890
(FAD_binding_2)
PF02910
(Succ_DH_flav_C)
3 ARG A 139
VAL A 105
THR A 159
None
0.81A 3tl9A-1qlbA:
undetectable
3tl9A-1qlbA:
12.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1t8t HEPARAN SULFATE
D-GLUCOSAMINYL
3-O-SULFOTRANSFERASE
3A1


(Homo sapiens)
PF00685
(Sulfotransfer_1)
3 ARG A 248
VAL A 379
THR A 270
None
0.64A 3tl9A-1t8tA:
undetectable
3tl9A-1t8tA:
15.89
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.
1tkc TRANSKETOLASE

(Saccharomyces
cerevisiae)
PF00456
(Transketolase_N)
PF02779
(Transket_pyr)
PF02780
(Transketolase_C)
3 ARG A 417
VAL A 446
THR A 441
None
0.79A 3tl9A-1tkcA:
undetectable
3tl9A-1tkcA:
9.14
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.
1ulv GLUCODEXTRANASE

(Arthrobacter
globiformis)
PF00723
(Glyco_hydro_15)
PF09136
(Glucodextran_B)
PF09137
(Glucodextran_N)
PF09985
(Glucodextran_C)
3 ARG A 768
VAL A 418
THR A 469
None
0.80A 3tl9A-1ulvA:
undetectable
3tl9A-1ulvA:
7.64
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.
1v9l GLUTAMATE
DEHYDROGENASE


(Pyrobaculum
islandicum)
PF00208
(ELFV_dehydrog)
PF02812
(ELFV_dehydrog_N)
3 ARG A 185
VAL A  72
THR A 148
None
0.85A 3tl9A-1v9lA:
undetectable
3tl9A-1v9lA:
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.
1vj7 BIFUNCTIONAL
RELA/SPOT


(Streptococcus
dysgalactiae)
PF04607
(RelA_SpoT)
PF13328
(HD_4)
3 ARG A 290
VAL A 282
THR A 313
None
0.71A 3tl9A-1vj7A:
undetectable
3tl9A-1vj7A:
14.40
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.
1wkk NUCLEOSIDE
DIPHOSPHATE KINASE


(Thermus
thermophilus)
PF00334
(NDK)
3 ARG A  31
VAL A  84
THR A   4
None
0.84A 3tl9A-1wkkA:
undetectable
3tl9A-1wkkA:
23.48
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.
1wko TERMINAL FLOWER 1
PROTEIN


(Arabidopsis
thaliana)
PF01161
(PBP)
3 ARG A 122
VAL A  71
THR A 148
None
0.84A 3tl9A-1wkoA:
undetectable
3tl9A-1wkoA:
23.81
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.
1wox HEME OXYGENASE 2

(Synechocystis
sp. PCC 6803)
PF01126
(Heme_oxygenase)
3 ARG A  39
VAL A 205
THR A  98
None
0.86A 3tl9A-1woxA:
undetectable
3tl9A-1woxA:
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.
1yb5 QUINONE
OXIDOREDUCTASE


(Homo sapiens)
PF00107
(ADH_zinc_N)
PF08240
(ADH_N)
3 ARG A  12
VAL A  73
THR A  98
None
0.66A 3tl9A-1yb5A:
undetectable
3tl9A-1yb5A:
14.83
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.
1ykd ADENYLATE CYCLASE

(Anabaena sp.)
PF01590
(GAF)
3 ARG A 236
VAL A 120
THR A  92
None
0.86A 3tl9A-1ykdA:
undetectable
3tl9A-1ykdA:
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.
1yr2 PROLYL
OLIGOPEPTIDASE


(Novosphingobium
capsulatum)
PF00326
(Peptidase_S9)
PF02897
(Peptidase_S9_N)
3 ARG A 101
VAL A 479
THR A 429
None
0.87A 3tl9A-1yr2A:
undetectable
3tl9A-1yr2A:
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.
1ywg GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE


(Plasmodium
falciparum)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
3 ARG O  16
VAL O 290
THR O 242
None
0.70A 3tl9A-1ywgO:
undetectable
3tl9A-1ywgO:
17.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2b9s TOPOISOMERASE I-LIKE
PROTEIN


(Leishmania
donovani)
PF01028
(Topoisom_I)
PF02919
(Topoisom_I_N)
3 ARG A 310
VAL A 447
THR A 417
None
0.85A 3tl9A-2b9sA:
undetectable
3tl9A-2b9sA:
13.30
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.
2bru NAD(P)
TRANSHYDROGENASE
SUBUNIT BETA


(Escherichia
coli)
PF02233
(PNTB)
3 ARG C  58
VAL C 109
THR C 106
None
0.76A 3tl9A-2bruC:
undetectable
3tl9A-2bruC:
21.69
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.
2bu2 PYRUVATE
DEHYDROGENSAE KINASE
ISOENZYME 2


(Homo sapiens)
PF02518
(HATPase_c)
PF10436
(BCDHK_Adom3)
3 ARG A 149
VAL A 138
THR A 376
None
0.85A 3tl9A-2bu2A:
undetectable
3tl9A-2bu2A:
16.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2c5s PROBABLE THIAMINE
BIOSYNTHESIS PROTEIN
THII


(Bacillus
anthracis)
PF02568
(ThiI)
PF02926
(THUMP)
3 ARG A 314
VAL A 207
THR A 272
None
0.67A 3tl9A-2c5sA:
undetectable
3tl9A-2c5sA:
12.65
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.
2col BIFUNCTIONAL
HEMOLYSIN-ADENYLATE
CYCLASE


(Bordetella
pertussis)
PF03497
(Anthrax_toxA)
3 ARG A  15
VAL A  43
THR A  48
None
0.66A 3tl9A-2colA:
undetectable
3tl9A-2colA:
15.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2dpw HYPOTHETICAL PROTEIN
TTHA0179


(Thermus
thermophilus)
PF12804
(NTP_transf_3)
3 ARG A 226
VAL A 222
THR A 131
None
0.81A 3tl9A-2dpwA:
undetectable
3tl9A-2dpwA:
17.03
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.
2egg SHIKIMATE
5-DEHYDROGENASE


(Geobacillus
kaustophilus)
PF01488
(Shikimate_DH)
PF08501
(Shikimate_dh_N)
3 ARG A 173
VAL A 146
THR A 211
None
0.84A 3tl9A-2eggA:
undetectable
3tl9A-2eggA:
16.61
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.
2ek8 AMINOPEPTIDASE

(Aneurinibacillus
sp. AM-1)
PF02225
(PA)
PF04389
(Peptidase_M28)
3 ARG A  42
VAL A 245
THR A 268
None
0.79A 3tl9A-2ek8A:
undetectable
3tl9A-2ek8A:
12.62
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.
2g5t DIPEPTIDYL PEPTIDASE
4


(Homo sapiens)
PF00326
(Peptidase_S9)
PF00930
(DPPIV_N)
3 ARG A 184
VAL A 155
THR A 152
None
0.76A 3tl9A-2g5tA:
undetectable
3tl9A-2g5tA:
10.97
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.
2gah HETEROTETRAMERIC
SARCOSINE OXIDASE
ALPHA-SUBUNIT


(Stenotrophomonas
maltophilia)
PF01571
(GCV_T)
PF07992
(Pyr_redox_2)
PF08669
(GCV_T_C)
PF13510
(Fer2_4)
3 ARG A 422
VAL A 246
THR A 435
None
0.79A 3tl9A-2gahA:
undetectable
3tl9A-2gahA:
7.05
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.
2gh8 CAPSID PROTEIN

(Vesicular
exanthema of
swine virus)
PF00915
(Calici_coat)
3 ARG A 385
VAL A 612
THR A 620
None
0.86A 3tl9A-2gh8A:
undetectable
3tl9A-2gh8A:
11.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2h7g DNA TOPOISOMERASE 1

(Variola virus)
PF01028
(Topoisom_I)
PF09266
(VirDNA-topo-I_N)
3 ARG X  86
VAL X 304
THR X 278
None
0.76A 3tl9A-2h7gX:
undetectable
3tl9A-2h7gX:
14.61
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.
2iht CARBOXYETHYLARGININE
SYNTHASE


(Streptomyces
clavuligerus)
PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N)
3 ARG A 229
VAL A  62
THR A  94
None
0.82A 3tl9A-2ihtA:
undetectable
3tl9A-2ihtA:
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.
2jzd REPLICASE
POLYPROTEIN 1AB


(Severe acute
respiratory
syndrome-related
coronavirus)
PF11633
(SUD-M)
3 ARG A 625
VAL A 635
THR A 528
None
0.86A 3tl9A-2jzdA:
undetectable
3tl9A-2jzdA:
20.93
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.
2lc0 PUTATIVE
UNCHARACTERIZED
PROTEIN TB39.8


(Mycobacterium
tuberculosis)
PF12401
(DUF3662)
3 ARG A  10
VAL A 125
THR A 100
None
0.78A 3tl9A-2lc0A:
undetectable
3tl9A-2lc0A:
28.06
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.
2ng1 SIGNAL SEQUENCE
RECOGNITION PROTEIN
FFH


(Thermus
aquaticus)
PF00448
(SRP54)
PF02881
(SRP54_N)
3 ARG A  36
VAL A  43
THR A  48
None
0.86A 3tl9A-2ng1A:
undetectable
3tl9A-2ng1A:
18.15
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.
2nwq PROBABLE SHORT-CHAIN
DEHYDROGENASE


(Pseudomonas
aeruginosa)
PF00106
(adh_short)
3 ARG A  80
VAL A  52
THR A  50
None
0.78A 3tl9A-2nwqA:
undetectable
3tl9A-2nwqA:
16.35
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.
2oap TYPE II SECRETION
SYSTEM PROTEIN


(Archaeoglobus
fulgidus)
PF00437
(T2SSE)
3 ARG 1 409
VAL 1 265
THR 1 276
None
0.82A 3tl9A-2oap1:
undetectable
3tl9A-2oap1:
14.65
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.
2owm RELATED TO
KINESIN-LIKE PROTEIN
KIF1C


(Neurospora
crassa)
PF00225
(Kinesin)
3 ARG A 294
VAL A  40
THR A 415
None
0.64A 3tl9A-2owmA:
undetectable
3tl9A-2owmA:
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.
2q0q ARYL ESTERASE

(Mycolicibacterium
smegmatis)
PF13472
(Lipase_GDSL_2)
3 ARG A  33
VAL A  19
THR A  25
GOL  A1730 (-2.9A)
None
None
0.82A 3tl9A-2q0qA:
undetectable
3tl9A-2q0qA:
18.72
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.
2qjg PUTATIVE ALDOLASE
MJ0400


(Methanocaldococcus
jannaschii)
PF01791
(DeoC)
3 ARG A 132
VAL A 105
THR A 140
None
0.88A 3tl9A-2qjgA:
undetectable
3tl9A-2qjgA:
15.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qpq PROTEIN BUG27

(Bordetella
pertussis)
PF03401
(TctC)
3 ARG A  83
VAL A  77
THR A 293
None
0.75A 3tl9A-2qpqA:
undetectable
3tl9A-2qpqA:
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.
2qqk NEUROPILIN-2

(Homo sapiens)
PF00431
(CUB)
PF00754
(F5_F8_type_C)
3 ARG A 518
VAL A 468
THR A 367
None
0.85A 3tl9A-2qqkA:
undetectable
3tl9A-2qqkA:
11.61
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.
2qxl HEAT SHOCK PROTEIN
HOMOLOG SSE1


(Saccharomyces
cerevisiae)
PF00012
(HSP70)
3 ARG A  70
VAL A 175
THR A 210
None
0.85A 3tl9A-2qxlA:
undetectable
3tl9A-2qxlA:
10.03
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.
2r9g AAA ATPASE, CENTRAL
REGION


(Enterococcus
faecium)
PF12002
(MgsA_C)
3 ARG A 278
VAL A 320
THR A 298
None
0.70A 3tl9A-2r9gA:
undetectable
3tl9A-2r9gA:
18.72
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.
2rc3 CBS DOMAIN

(Nitrosomonas
europaea)
PF00571
(CBS)
3 ARG A 124
VAL A 102
THR A  99
BR  A 171 (-4.4A)
None
BR  A 177 ( 4.2A)
0.88A 3tl9A-2rc3A:
undetectable
3tl9A-2rc3A:
22.06
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.
2uvd 3-OXOACYL-(ACYL-CARR
IER-PROTEIN)
REDUCTASE


(Bacillus
anthracis)
PF13561
(adh_short_C2)
3 ARG A  60
VAL A  92
THR A 112
None
0.70A 3tl9A-2uvdA:
undetectable
3tl9A-2uvdA:
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.
2w45 ALKALINE EXONUCLEASE

(Human
gammaherpesvirus
4)
PF01771
(Herpes_alk_exo)
3 ARG A  45
VAL A  32
THR A 454
None
0.76A 3tl9A-2w45A:
undetectable
3tl9A-2w45A:
14.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2xub DNA-DIRECTED RNA
POLYMERASE III
SUBUNIT RPC3


(Homo sapiens)
PF05645
(RNA_pol_Rpc82)
PF08221
(HTH_9)
3 ARG A 150
VAL A 107
THR A  95
None
0.79A 3tl9A-2xubA:
undetectable
3tl9A-2xubA:
12.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ycb CLEAVAGE AND
POLYADENYLATION
SPECIFICITY FACTOR


(Methanothermobacter
thermautotrophicus)
PF07521
(RMMBL)
PF10996
(Beta-Casp)
PF16661
(Lactamase_B_6)
PF17214
(KH_7)
3 ARG A 149
VAL A 298
THR A 274
None
0.88A 3tl9A-2ycbA:
undetectable
3tl9A-2ycbA:
11.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2yfq NAD-SPECIFIC
GLUTAMATE
DEHYDROGENASE


(Peptoniphilus
asaccharolyticus)
PF00208
(ELFV_dehydrog)
PF02812
(ELFV_dehydrog_N)
3 ARG A 187
VAL A  73
THR A 149
SO4  A1423 (-2.1A)
None
None
0.78A 3tl9A-2yfqA:
undetectable
3tl9A-2yfqA:
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.
2z61 PROBABLE ASPARTATE
AMINOTRANSFERASE 2


(Methanocaldococcus
jannaschii)
PF00155
(Aminotran_1_2)
3 ARG A 230
VAL A  48
THR A  43
LLP  A 222 ( 2.8A)
None
None
0.73A 3tl9A-2z61A:
undetectable
3tl9A-2z61A:
14.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3a2q 6-AMINOHEXANOATE-CYC
LIC-DIMER HYDROLASE


(Arthrobacter
sp. KI72)
PF01425
(Amidase)
3 ARG A 138
VAL A 181
THR A 393
None
0.84A 3tl9A-3a2qA:
undetectable
3tl9A-3a2qA:
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.
3a71 EXO-ARABINANASE

(Penicillium
chrysogenum)
no annotation 3 ARG A 164
VAL A 172
THR A 137
None
0.82A 3tl9A-3a71A:
undetectable
3tl9A-3a71A:
13.16
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.
3axs PROBABLE
N(2),N(2)-DIMETHYLGU
ANOSINE TRNA
METHYLTRANSFERASE
TRM1


(Aquifex
aeolicus)
PF02005
(TRM)
3 ARG A 192
VAL A 358
THR A 355
None
0.78A 3tl9A-3axsA:
undetectable
3tl9A-3axsA:
14.40
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.
3ckb SUSD

(Bacteroides
thetaiotaomicron)
PF07980
(SusD_RagB)
3 ARG A 294
VAL A 303
THR A 316
None
0.79A 3tl9A-3ckbA:
undetectable
3tl9A-3ckbA:
11.73
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.
3cps GLYCERALDEHYDE
3-PHOSPHATE
DEHYDROGENASE


(Cryptosporidium
parvum)
PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C)
3 ARG A 252
VAL A 261
THR A 169
None
0.81A 3tl9A-3cpsA:
undetectable
3tl9A-3cpsA:
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.
3d3y UNCHARACTERIZED
PROTEIN


(Enterococcus
faecalis)
PF05193
(Peptidase_M16_C)
3 ARG A 343
VAL A 274
THR A 350
None
0.84A 3tl9A-3d3yA:
undetectable
3tl9A-3d3yA:
14.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ff2 UNCHARACTERIZED
CYSTATIN FOLD
PROTEIN
(YP_497570.1) FROM
NTF2 SUPERFAMILY


(Novosphingobium
aromaticivorans)
PF12680
(SnoaL_2)
3 ARG A 111
VAL A  23
THR A  47
None
0.80A 3tl9A-3ff2A:
undetectable
3tl9A-3ff2A:
17.80
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.
3fkj PUTATIVE
PHOSPHOSUGAR
ISOMERASES


(Salmonella
enterica)
PF01380
(SIS)
3 ARG A  23
VAL A  92
THR A  64
None
0.86A 3tl9A-3fkjA:
undetectable
3tl9A-3fkjA:
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.
3grf ORNITHINE
CARBAMOYLTRANSFERASE


(Giardia
intestinalis)
PF00185
(OTCace)
PF02729
(OTCace_N)
3 ARG A 255
VAL A 264
THR A 239
None
0.80A 3tl9A-3grfA:
undetectable
3tl9A-3grfA:
16.88
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.
3gt5 N-ACETYLGLUCOSAMINE
2-EPIMERASE


(Xylella
fastidiosa)
PF07221
(GlcNAc_2-epim)
3 ARG A 204
VAL A 125
THR A 147
None
0.71A 3tl9A-3gt5A:
undetectable
3tl9A-3gt5A:
12.89
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.
3hdx SUSD SUPERFAMILY
PROTEIN


(Bacteroides
thetaiotaomicron)
PF07980
(SusD_RagB)
PF14322
(SusD-like_3)
3 ARG A 161
VAL A 106
THR A  68
None
0.83A 3tl9A-3hdxA:
undetectable
3tl9A-3hdxA:
10.67
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.
3hpf MUCONATE
CYCLOISOMERASE


(Oceanobacillus
iheyensis)
PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C)
3 ARG A  15
VAL A 338
THR A 304
GAE  A 411 (-3.0A)
None
None
0.87A 3tl9A-3hpfA:
undetectable
3tl9A-3hpfA:
13.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3i2m ORF59

(Human
gammaherpesvirus
8)
PF04929
(Herpes_DNAp_acc)
3 ARG X  21
VAL X  48
THR X  30
None
0.85A 3tl9A-3i2mX:
undetectable
3tl9A-3i2mX:
17.92
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.
3in5 DNA POLYMERASE KAPPA

(Homo sapiens)
PF00817
(IMS)
PF11798
(IMS_HHH)
PF11799
(IMS_C)
3 ARG A 298
VAL A 177
THR A 305
None
0.87A 3tl9A-3in5A:
undetectable
3tl9A-3in5A:
11.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ism CG4930
CG8862


(Drosophila
melanogaster)
PF01223
(Endonuclease_NS)
PF08785
(Ku_PK_bind)
3 ARG A 153
VAL C  50
THR C  55
None
0.79A 3tl9A-3ismA:
undetectable
3tl9A-3ismA:
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.
3it4 ARGININE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
ARGJ ALPHA CHAIN


(Mycobacterium
tuberculosis)
PF01960
(ArgJ)
3 ARG A 133
VAL A 124
THR A 102
None
0.87A 3tl9A-3it4A:
undetectable
3tl9A-3it4A:
16.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3jb9 PRE-MRNA-SPLICING
FACTOR SPP42


(Schizosaccharomyces
pombe)
PF08082
(PRO8NT)
PF08083
(PROCN)
PF10596
(U6-snRNA_bdg)
PF10597
(U5_2-snRNA_bdg)
PF10598
(RRM_4)
PF12134
(PRP8_domainIV)
3 ARG A  94
VAL A 519
THR A 148
None
0.77A 3tl9A-3jb9A:
undetectable
3tl9A-3jb9A:
3.81
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.
3ksd GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE
1


(Staphylococcus
aureus)
no annotation 3 ARG Q  15
VAL Q 284
THR Q 239
None
0.67A 3tl9A-3ksdQ:
undetectable
3tl9A-3ksdQ:
14.88
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.
3kya PUTATIVE PHOSPHATASE

(Bacteroides
thetaiotaomicron)
PF01833
(TIG)
3 ARG A 466
VAL A 462
THR A 444
None
0.85A 3tl9A-3kyaA:
undetectable
3tl9A-3kyaA:
12.03
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.
3l6r SERINE RACEMASE

(Homo sapiens)
PF00291
(PALP)
3 ARG A 277
VAL A 293
THR A  38
None
0.83A 3tl9A-3l6rA:
undetectable
3tl9A-3l6rA:
16.22
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.
3ll9 ISOPENTENYL
PHOSPHATE KINASE


(Methanothermobacter
thermautotrophicus)
PF00696
(AA_kinase)
3 ARG A  59
VAL A 142
THR A  80
None
0.88A 3tl9A-3ll9A:
undetectable
3tl9A-3ll9A:
16.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3lm6 STAGE V SPORULATION
PROTEIN AD


(Bacillus
subtilis)
PF07451
(SpoVAD)
3 ARG A 295
VAL A 284
THR A  22
None
0.84A 3tl9A-3lm6A:
undetectable
3tl9A-3lm6A:
13.16
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.
3mcu DIPICOLINATE
SYNTHASE, B CHAIN


(Bacillus cereus)
PF02441
(Flavoprotein)
3 ARG A  37
VAL A 124
THR A 117
None
0.65A 3tl9A-3mcuA:
undetectable
3tl9A-3mcuA:
21.38
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.
3mcu DIPICOLINATE
SYNTHASE, B CHAIN


(Bacillus cereus)
PF02441
(Flavoprotein)
3 ARG A 170
VAL A 125
THR A 177
None
0.87A 3tl9A-3mcuA:
undetectable
3tl9A-3mcuA:
21.38
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3mws HIV-1 PROTEASE

(Human
immunodeficiency
virus 1)
PF00077
(RVP)
3 ARG A   8
VAL A  32
THR A  80
None
0.69A 3tl9A-3mwsA:
19.8
3tl9A-3mwsA:
79.80
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.
3ol2 SEMAPHORIN-4D

(Homo sapiens)
PF00047
(ig)
PF01403
(Sema)
PF01437
(PSI)
3 ARG A 412
VAL A 404
THR A 332
None
0.84A 3tl9A-3ol2A:
undetectable
3tl9A-3ol2A:
9.05
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.
3pdw UNCHARACTERIZED
HYDROLASE YUTF


(Bacillus
subtilis)
PF13242
(Hydrolase_like)
PF13344
(Hydrolase_6)
3 ARG A 124
VAL A 119
THR A 147
None
0.82A 3tl9A-3pdwA:
undetectable
3tl9A-3pdwA:
18.86
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.
3r6o 2-HYDROXYHEPTA-2,4-D
IENE-1,
7-DIOATEISOMERASE


(Mycobacteroides
abscessus)
PF01557
(FAA_hydrolase)
3 ARG A 129
VAL A 125
THR A 197
None
0.86A 3tl9A-3r6oA:
undetectable
3tl9A-3r6oA:
17.70
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.
3r75 ANTHRANILATE/PARA-AM
INOBENZOATE
SYNTHASES COMPONENT
I


(Burkholderia
lata)
PF00117
(GATase)
PF00425
(Chorismate_bind)
3 ARG A 504
VAL A 473
THR A 457
None
0.75A 3tl9A-3r75A:
undetectable
3tl9A-3r75A:
10.23
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.
3rhy N(G),N(G)-DIMETHYLAR
GININE
DIMETHYLAMINOHYDROLA
SE


(Pseudomonas
aeruginosa)
PF02274
(Amidinotransf)
3 ARG A  85
VAL A 160
THR A 165
HM3  A 255 ( 4.7A)
None
None
0.73A 3tl9A-3rhyA:
undetectable
3tl9A-3rhyA:
15.62
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.
3sr6 XANTHINE
DEHYDROGENASE/OXIDAS
E


(Bos taurus)
PF01315
(Ald_Xan_dh_C)
PF02738
(Ald_Xan_dh_C2)
3 ARG C1279
VAL C1310
THR C1286
None
0.86A 3tl9A-3sr6C:
undetectable
3tl9A-3sr6C:
10.16
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.
3tsd INOSINE-5'-MONOPHOSP
HATE DEHYDROGENASE


(Bacillus
anthracis)
PF00478
(IMPDH)
PF00571
(CBS)
3 ARG A 440
VAL A 360
THR A  34
None
0.43A 3tl9A-3tsdA:
undetectable
3tl9A-3tsdA:
12.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3u44 ATP-DEPENDENT
HELICASE/DEOXYRIBONU
CLEASE SUBUNIT B


(Bacillus
subtilis)
PF12705
(PDDEXK_1)
3 ARG B  84
VAL B  75
THR B  79
None
0.86A 3tl9A-3u44B:
undetectable
3tl9A-3u44B:
6.92
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.
3vi3 INTEGRIN ALPHA-5

(Homo sapiens)
PF01839
(FG-GAP)
PF08441
(Integrin_alpha2)
3 ARG A 423
VAL A 369
THR A 292
None
0.80A 3tl9A-3vi3A:
undetectable
3tl9A-3vi3A:
11.55
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.
3vys HYDROGENASE
EXPRESSION/FORMATION
PROTEIN HYPD


(Thermococcus
kodakarensis)
PF01924
(HypD)
3 ARG B  84
VAL B  73
THR B 106
None
0.70A 3tl9A-3vysB:
undetectable
3tl9A-3vysB:
12.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3wdj TYPE I PULLULANASE

(Anoxybacillus
sp. LM18-11)
PF00128
(Alpha-amylase)
PF02922
(CBM_48)
3 ARG A 321
VAL A 344
THR A 301
None
0.84A 3tl9A-3wdjA:
undetectable
3tl9A-3wdjA:
9.75
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.
3wst PROTEIN ARGININE
N-METHYLTRANSFERASE
7


(Caenorhabditis
elegans)
PF13649
(Methyltransf_25)
3 ARG A 122
VAL A 118
THR A  73
SAH  A 701 (-4.0A)
None
None
0.85A 3tl9A-3wstA:
undetectable
3tl9A-3wstA:
10.82