SIMILAR PATTERNS OF AMINO ACIDS FOR 3N8X_B_NIMB1701_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.
1bfo CAMPATH-1G ANTIBODY

(Rattus rattus)
PF07654
(C1-set)
PF07686
(V-set)
3 VAL B 199
VAL B 171
SER B 169
None
0.63A 3n8xB-1bfoB:
0.0
3n8xB-1bfoB:
15.83
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.
1csj HEPATITIS C VIRUS
RNA POLYMERASE
(NS5B)


(Hepacivirus C)
PF00998
(RdRP_3)
3 VAL A  52
VAL A 161
SER A 282
None
0.69A 3n8xB-1csjA:
0.0
3n8xB-1csjA:
20.73
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.
1dci DIENOYL-COA
ISOMERASE


(Rattus
norvegicus)
PF00378
(ECH_1)
3 VAL A 221
VAL A 175
SER A 179
None
0.59A 3n8xB-1dciA:
0.0
3n8xB-1dciA:
18.66
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.
1e12 HALORHODOPSIN

(Halobacterium
salinarum)
PF01036
(Bac_rhodopsin)
3 VAL A  86
VAL A 227
SER A 231
None
0.74A 3n8xB-1e12A:
0.0
3n8xB-1e12A:
17.06
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1ebv PROSTAGLANDIN H2
SYNTHASE


(Ovis aries)
PF00008
(EGF)
PF03098
(An_peroxidase)
3 VAL A 116
VAL A 349
SER A 353
None
SCL  A 700 ( 4.6A)
None
0.28A 3n8xB-1ebvA:
61.5
3n8xB-1ebvA:
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.
1g38 MODIFICATION
METHYLASE TAQI


(Thermus
aquaticus)
PF07669
(Eco57I)
PF12950
(TaqI_C)
3 VAL A 170
VAL A 204
SER A 202
None
0.68A 3n8xB-1g38A:
0.0
3n8xB-1g38A:
23.56
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.
1gju MALTODEXTRIN
GLYCOSYLTRANSFERASE


(Thermotoga
maritima)
PF00128
(Alpha-amylase)
PF09083
(DUF1923)
3 VAL A 431
VAL A  86
SER A  84
None
0.74A 3n8xB-1gjuA:
0.0
3n8xB-1gjuA:
22.07
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.
1i5a CHEMOTAXIS PROTEIN
CHEA


(Thermotoga
maritima)
PF02518
(HATPase_c)
3 VAL A 514
VAL A 533
SER A 522
None
0.72A 3n8xB-1i5aA:
undetectable
3n8xB-1i5aA:
15.63
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.
1sxj ACTIVATOR 1 40 KDA
SUBUNIT


(Saccharomyces
cerevisiae)
PF13177
(DNA_pol3_delta2)
3 VAL E 116
VAL E  87
SER E  89
None
0.75A 3n8xB-1sxjE:
2.3
3n8xB-1sxjE:
21.10
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.
1tul TLP20

(Autographa
californica
multiple
nucleopolyhedrovirus)
PF06088
(TLP-20)
3 VAL A  76
VAL A  47
SER A  49
None
0.72A 3n8xB-1tulA:
undetectable
3n8xB-1tulA:
11.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1vl1 6-PHOSPHOGLUCONOLACT
ONASE


(Thermotoga
maritima)
PF01182
(Glucosamine_iso)
3 VAL A 208
VAL A  38
SER A  67
None
0.72A 3n8xB-1vl1A:
undetectable
3n8xB-1vl1A:
16.27
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.
1xgy K42-41L FAB HEAVY
CHAIN


(Mus musculus)
PF07654
(C1-set)
PF07686
(V-set)
3 VAL H 193
VAL H 163
SER H 161
None
0.64A 3n8xB-1xgyH:
undetectable
3n8xB-1xgyH:
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.
1y12 HYPOTHETICAL PROTEIN
PA0085


(Pseudomonas
aeruginosa)
PF05638
(T6SS_HCP)
3 VAL A 107
VAL A  12
SER A  65
None
0.73A 3n8xB-1y12A:
undetectable
3n8xB-1y12A:
13.20
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.
1y25 PROBABLE THIOL
PEROXIDASE


(Mycobacterium
tuberculosis)
PF08534
(Redoxin)
3 VAL A 147
VAL A  59
SER A  63
None
ACT  A1200 (-3.7A)
None
0.57A 3n8xB-1y25A:
undetectable
3n8xB-1y25A:
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.
1z26 ARGONAUTE

(Pyrococcus
furiosus)
PF02171
(Piwi)
PF12212
(PAZ_siRNAbind)
3 VAL A 459
VAL A 500
SER A 502
None
0.72A 3n8xB-1z26A:
undetectable
3n8xB-1z26A:
20.23
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.
1z3i SIMILAR TO
RAD54-LIKE


(Danio rerio)
PF00176
(SNF2_N)
PF00271
(Helicase_C)
3 VAL X 725
VAL X 494
SER X 717
None
0.68A 3n8xB-1z3iX:
undetectable
3n8xB-1z3iX:
21.08
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.
1zq9 PROBABLE
DIMETHYLADENOSINE
TRANSFERASE


(Homo sapiens)
PF00398
(RrnaAD)
3 VAL A 232
VAL A 247
SER A 244
None
0.73A 3n8xB-1zq9A:
undetectable
3n8xB-1zq9A:
17.99
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.
1ztv HYPOTHETICAL PROTEIN

(Enterococcus
faecalis)
PF01904
(DUF72)
3 VAL A  62
VAL A 165
SER A 163
None
0.66A 3n8xB-1ztvA:
undetectable
3n8xB-1ztvA:
19.24
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.
2ae0 MEMBRANE-BOUND LYTIC
MUREIN
TRANSGLYCOSYLASE A


(Escherichia
coli)
PF03562
(MltA)
PF06725
(3D)
3 VAL X 332
VAL X 258
SER X 260
EDO  X1439 ( 4.5A)
None
None
0.74A 3n8xB-2ae0X:
undetectable
3n8xB-2ae0X:
18.75
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.
2b0t NADP ISOCITRATE
DEHYDROGENASE


(Corynebacterium
glutamicum)
PF03971
(IDH)
3 VAL A 381
VAL A 403
SER A 536
None
0.70A 3n8xB-2b0tA:
undetectable
3n8xB-2b0tA:
21.91
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.
2dt8 DEGV FAMILY PROTEIN

(Thermus
thermophilus)
PF02645
(DegV)
3 VAL A 122
VAL A  96
SER A  93
None
None
PLM  A 701 (-2.5A)
0.71A 3n8xB-2dt8A:
undetectable
3n8xB-2dt8A:
21.04
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.
2fjk FRUCTOSE-BISPHOSPHAT
E ALDOLASE


(Thermus
caldophilus)
PF01116
(F_bP_aldolase)
3 VAL A  73
VAL A  19
SER A 301
None
0.58A 3n8xB-2fjkA:
undetectable
3n8xB-2fjkA:
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.
2hpi DNA POLYMERASE III
ALPHA SUBUNIT


(Thermus
aquaticus)
PF02811
(PHP)
PF07733
(DNA_pol3_alpha)
PF14579
(HHH_6)
3 VAL A 679
VAL A 667
SER A 825
None
0.74A 3n8xB-2hpiA:
undetectable
3n8xB-2hpiA:
18.65
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.
2j3h NADP-DEPENDENT
OXIDOREDUCTASE P1


(Arabidopsis
thaliana)
PF00107
(ADH_zinc_N)
PF16884
(ADH_N_2)
3 VAL A 342
VAL A 104
SER A 110
None
0.68A 3n8xB-2j3hA:
undetectable
3n8xB-2j3hA:
22.05
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.
2j3s FILAMIN-A

(Homo sapiens)
PF00630
(Filamin)
3 VAL A2134
VAL A2090
SER A2088
None
0.63A 3n8xB-2j3sA:
undetectable
3n8xB-2j3sA:
19.30
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.
2nas UNCHARACTERIZED
PROTEIN


(Trypanosoma
brucei)
PF00855
(PWWP)
3 VAL A  11
VAL A  42
SER A   4
None
0.75A 3n8xB-2nasA:
undetectable
3n8xB-2nasA:
12.33
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.
2o69 IRON-UTILIZATION
PERIPLASMIC PROTEIN


(Haemophilus
influenzae)
PF01547
(SBP_bac_1)
3 VAL A 104
VAL A 182
SER A 211
None
0.74A 3n8xB-2o69A:
undetectable
3n8xB-2o69A:
19.34
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.
2p88 MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN


(Bacillus cereus)
PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C)
3 VAL A 136
VAL A 297
SER A 295
None
0.75A 3n8xB-2p88A:
undetectable
3n8xB-2p88A:
20.46
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.
2y5w KINESIN HEAVY CHAIN

(Drosophila
melanogaster)
PF00225
(Kinesin)
3 VAL A  58
VAL A  35
SER A  47
None
0.69A 3n8xB-2y5wA:
undetectable
3n8xB-2y5wA:
18.39
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.
2y89 PHOSPHORIBOSYL
ISOMERASE A


(Mycobacterium
tuberculosis)
PF00977
(His_biosynth)
3 VAL A  52
VAL A 168
SER A 200
None
0.73A 3n8xB-2y89A:
undetectable
3n8xB-2y89A:
17.84
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.
2ypd PROBABLE JMJC
DOMAIN-CONTAINING
HISTONE
DEMETHYLATION PROT
EIN 2C


(Homo sapiens)
PF02373
(JmjC)
3 VAL A2477
VAL A2197
SER A2284
None
0.65A 3n8xB-2ypdA:
undetectable
3n8xB-2ypdA:
22.54
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.
2yxx DIAMINOPIMELATE
DECARBOXYLASE


(Thermotoga
maritima)
PF00278
(Orn_DAP_Arg_deC)
PF02784
(Orn_Arg_deC_N)
3 VAL A  66
VAL A  80
SER A  82
None
0.67A 3n8xB-2yxxA:
undetectable
3n8xB-2yxxA:
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.
3c60 TCR YAE62 ALPHA
CHAIN


(Mus musculus)
PF07686
(V-set)
PF09291
(DUF1968)
3 VAL A 120
VAL A 145
SER A 191
None
0.73A 3n8xB-3c60A:
undetectable
3n8xB-3c60A:
15.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3dmm T-CELL SURFACE
GLYCOPROTEIN CD8
BETA CHAIN


(Mus musculus)
PF07686
(V-set)
3 VAL D  63
VAL D  57
SER D  50
None
0.74A 3n8xB-3dmmD:
undetectable
3n8xB-3dmmD:
13.26
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.
3gsz RNA-DIRECTED RNA
POLYMERASE


(Hepacivirus C)
PF00998
(RdRP_3)
3 VAL A  52
VAL A 161
SER A 282
None
0.60A 3n8xB-3gszA:
undetectable
3n8xB-3gszA:
22.69
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.
3hps 2-ISOPROPYLMALATE
SYNTHASE


(Mycobacterium
tuberculosis)
PF00682
(HMGL-like)
PF08502
(LeuA_dimer)
3 VAL A  53
VAL A 262
SER A 266
None
0.45A 3n8xB-3hpsA:
undetectable
3n8xB-3hpsA:
21.57
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.
3hpx 2-ISOPROPYLMALATE
SYNTHASE


(Mycobacterium
tuberculosis)
PF00682
(HMGL-like)
3 VAL A  53
VAL A 262
SER A 266
None
0.47A 3n8xB-3hpxA:
undetectable
3n8xB-3hpxA:
19.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3j81 US5

(Kluyveromyces
lactis)
PF00333
(Ribosomal_S5)
PF03719
(Ribosomal_S5_C)
3 VAL C 170
VAL C 189
SER C 186
C  2  14 ( 4.5A)
None
U  2   5 ( 3.2A)
0.72A 3n8xB-3j81C:
undetectable
3n8xB-3j81C:
18.30
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.
3k4w UNCHARACTERIZED
PROTEIN BB4693


(Bordetella
bronchiseptica)
PF04909
(Amidohydro_2)
3 VAL A  94
VAL A 185
SER A 187
None
0.69A 3n8xB-3k4wA:
undetectable
3n8xB-3k4wA:
19.29
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.
3mmp ELONGATION FACTOR TU
2, ELONGATION FACTOR
TS


(Escherichia
coli)
PF00009
(GTP_EFTU)
PF00889
(EF_TS)
PF03143
(GTP_EFTU_D3)
PF03144
(GTP_EFTU_D2)
3 VAL A 226
VAL A 190
SER A 186
None
0.67A 3n8xB-3mmpA:
undetectable
3n8xB-3mmpA:
20.52
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.
3nby SNURPORTIN-1

(Homo sapiens)
PF11538
(Snurportin1)
3 VAL B 281
VAL B 244
SER B 246
None
0.68A 3n8xB-3nbyB:
undetectable
3n8xB-3nbyB:
20.07
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.
3pw3 AMINOPEPTIDASE C

(Parabacteroides
distasonis)
PF03051
(Peptidase_C1_2)
3 VAL A 359
VAL A 272
SER A 270
None
0.60A 3n8xB-3pw3A:
undetectable
3n8xB-3pw3A:
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.
3q94 FRUCTOSE-BISPHOSPHAT
E ALDOLASE, CLASS II


(Bacillus
anthracis)
PF01116
(F_bP_aldolase)
3 VAL A  78
VAL A  20
SER A 281
None
0.67A 3n8xB-3q94A:
undetectable
3n8xB-3q94A:
19.62
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.
3r4k TRANSCRIPTIONAL
REGULATOR, ICLR
FAMILY


(Ruegeria sp.
TM1040)
PF01614
(IclR)
PF09339
(HTH_IclR)
3 VAL A 179
VAL A 150
SER A 145
None
0.74A 3n8xB-3r4kA:
undetectable
3n8xB-3r4kA:
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.
3r6m YEAZ, RESUSCITATION
PROMOTING FACTOR


(Vibrio
parahaemolyticus)
PF00814
(Peptidase_M22)
3 VAL A  46
VAL A 196
SER A 192
None
0.59A 3n8xB-3r6mA:
undetectable
3n8xB-3r6mA:
16.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3r7w GTP-BINDING PROTEIN
GTR2


(Saccharomyces
cerevisiae)
PF04670
(Gtr1_RagA)
3 VAL B 179
VAL B  29
SER B 212
None
0.75A 3n8xB-3r7wB:
undetectable
3n8xB-3r7wB:
20.32
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.
3rjl 1-PYRROLINE-5-CARBOX
YLATE DEHYDROGENASE


(Bacillus
licheniformis)
PF00171
(Aldedh)
3 VAL A 232
VAL A 101
SER A 225
None
0.70A 3n8xB-3rjlA:
2.1
3n8xB-3rjlA:
21.23
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.
3t8l ADENINE DEAMINASE 2

(Agrobacterium
fabrum)
PF01979
(Amidohydro_1)
PF13382
(Adenine_deam_C)
3 VAL A 109
VAL A 291
SER A  98
None
0.60A 3n8xB-3t8lA:
undetectable
3n8xB-3t8lA:
21.23
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.
3ucq AMYLOSUCRASE

(Deinococcus
geothermalis)
PF00128
(Alpha-amylase)
3 VAL A 492
VAL A 173
SER A 171
None
0.70A 3n8xB-3ucqA:
undetectable
3n8xB-3ucqA:
21.45
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.
3uw3 ASPARTATE-SEMIALDEHY
DE DEHYDROGENASE


(Burkholderia
thailandensis)
PF01118
(Semialdhyde_dh)
PF02774
(Semialdhyde_dhC)
3 VAL A 309
VAL A 325
SER A 321
None
0.70A 3n8xB-3uw3A:
3.3
3n8xB-3uw3A:
21.45
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.
3vr5 V-TYPE SODIUM ATPASE
SUBUNIT B


(Enterococcus
hirae)
PF00006
(ATP-synt_ab)
PF02874
(ATP-synt_ab_N)
3 VAL D  11
VAL D  32
SER D  68
None
0.67A 3n8xB-3vr5D:
undetectable
3n8xB-3vr5D:
22.18
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.
3vx8 UBIQUITIN-LIKE
MODIFIER-ACTIVATING
ENZYME ATG7


(Arabidopsis
thaliana)
no annotation 3 VAL D 185
VAL D 285
SER D 283
None
0.73A 3n8xB-3vx8D:
undetectable
3n8xB-3vx8D:
20.11
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.
4af2 THIOL PEROXIDASE

(Escherichia
coli)
PF08534
(Redoxin)
3 VAL A 150
VAL A  60
SER A  64
None
0.62A 3n8xB-4af2A:
undetectable
3n8xB-4af2A:
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.
4b2o YMDB
PHOSPHODIESTERASE


(Bacillus
subtilis)
PF13277
(YmdB)
3 VAL A   9
VAL A  22
SER A  58
None
0.70A 3n8xB-4b2oA:
undetectable
3n8xB-4b2oA:
19.39
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.
4btg MAJOR INNER PROTEIN
P1


(Pseudomonas
virus phi6)
no annotation 3 VAL A 190
VAL A 253
SER A 251
None
0.69A 3n8xB-4btgA:
undetectable
3n8xB-4btgA:
19.95
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.
4dz4 AGMATINASE

(Burkholderia
thailandensis)
PF00491
(Arginase)
3 VAL A  47
VAL A  69
SER A  73
None
0.71A 3n8xB-4dz4A:
undetectable
3n8xB-4dz4A:
18.93
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.
4fn5 ELONGATION FACTOR G
1


(Pseudomonas
aeruginosa)
PF00009
(GTP_EFTU)
PF00679
(EFG_C)
PF03144
(GTP_EFTU_D2)
PF03764
(EFG_IV)
PF14492
(EFG_II)
3 VAL A 673
VAL A 622
SER A 684
None
0.62A 3n8xB-4fn5A:
undetectable
3n8xB-4fn5A:
20.83
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.
4hds ARSB

(Sporomusa ovata)
PF02277
(DBI_PRT)
3 VAL B 101
VAL B 247
SER B 274
EDO  B 902 ( 4.4A)
None
None
0.71A 3n8xB-4hdsB:
undetectable
3n8xB-4hdsB:
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.
4i99 CHROMOSOME PARTITION
PROTEIN SMC


(Pyrococcus
furiosus)
PF02463
(SMC_N)
3 VAL A  20
VAL A1149
SER A  14
None
0.68A 3n8xB-4i99A:
3.0
3n8xB-4i99A:
20.45
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.
4i9f GLYCEROL 3-PHOSPHATE
PHOSPHATASE


(Mycobacterium
tuberculosis)
PF13242
(Hydrolase_like)
PF13344
(Hydrolase_6)
3 VAL A 207
VAL A  36
SER A  32
None
0.74A 3n8xB-4i9fA:
undetectable
3n8xB-4i9fA:
20.11
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.
4i9u L-LACTATE
DEHYDROGENASE A
CHAIN


(Oryctolagus
cuniculus)
PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C)
3 VAL A 255
VAL A 139
SER A 136
None
0.75A 3n8xB-4i9uA:
undetectable
3n8xB-4i9uA:
19.55
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.
4inj LMO1638 PROTEIN

(Listeria
monocytogenes)
PF02016
(Peptidase_S66)
3 VAL A  29
VAL A  49
SER A  20
None
0.63A 3n8xB-4injA:
undetectable
3n8xB-4injA:
22.30
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.
4j5t MANNOSYL-OLIGOSACCHA
RIDE GLUCOSIDASE


(Saccharomyces
cerevisiae)
PF03200
(Glyco_hydro_63)
PF16923
(Glyco_hydro_63N)
3 VAL A 216
VAL A 123
SER A 121
None
0.71A 3n8xB-4j5tA:
undetectable
3n8xB-4j5tA:
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.
4jy4 PGT121 HEAVY CHAIN

(Homo sapiens)
PF07654
(C1-set)
PF07686
(V-set)
3 VAL B  51
VAL B  67
SER B  81
None
0.71A 3n8xB-4jy4B:
undetectable
3n8xB-4jy4B:
16.18
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.
4kss TYPE II SECRETION
SYSTEM PROTEIN E,
HEMOLYSIN-COREGULATE
D PROTEIN


(Pseudomonas
aeruginosa;
Vibrio cholerae)
PF00437
(T2SSE)
PF05638
(T6SS_HCP)
3 VAL A 616
VAL A 521
SER A 574
None
0.74A 3n8xB-4kssA:
undetectable
3n8xB-4kssA:
21.26
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.
4lrj EFFECTOR NLEH1

(Escherichia
coli)
no annotation 3 VAL A 288
VAL A 245
SER A 208
None
0.72A 3n8xB-4lrjA:
undetectable
3n8xB-4lrjA:
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.
4nv0 7-METHYLGUANOSINE
PHOSPHATE-SPECIFIC
5'-NUCLEOTIDASE


(Drosophila
melanogaster)
PF05822
(UMPH-1)
3 VAL A 242
VAL A 256
SER A 259
None
0.75A 3n8xB-4nv0A:
undetectable
3n8xB-4nv0A:
20.52
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.
4o48 UNCHARACTERIZED
PROTEIN


(Cavia porcellus)
PF01112
(Asparaginase_2)
3 VAL A 108
VAL A  95
SER A  93
None
0.72A 3n8xB-4o48A:
undetectable
3n8xB-4o48A:
18.39
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.
4oxi ENTEROBACTIN
SYNTHETASE COMPONENT
F-RELATED PROTEIN


(Vibrio cholerae)
PF00501
(AMP-binding)
3 VAL A 440
VAL A 355
SER A 358
None
0.72A 3n8xB-4oxiA:
undetectable
3n8xB-4oxiA:
22.22
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.
4p3z COPN

(Chlamydia
pneumoniae)
PF07201
(HrpJ)
3 VAL A 284
VAL A 329
SER A 310
None
None
MLZ  A 313 ( 3.2A)
0.66A 3n8xB-4p3zA:
1.4
3n8xB-4p3zA:
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.
4pc9 C4-DICARBOXYLATE
TRANSPORT SYSTEM,
SUBSTRATE-BINDING
PROTEIN, PUTATIVE


(Roseobacter
denitrificans)
PF03480
(DctP)
3 VAL A 175
VAL A 234
SER A 236
CS2  A 401 (-4.6A)
None
None
0.68A 3n8xB-4pc9A:
undetectable
3n8xB-4pc9A:
19.05
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4ph9 PROSTAGLANDIN G/H
SYNTHASE 2


(Mus musculus)
PF00008
(EGF)
PF03098
(An_peroxidase)
3 VAL A 117
VAL A 350
SER A 354
BOG  A 604 (-3.9A)
IBP  A 601 (-4.3A)
None
0.12A 3n8xB-4ph9A:
57.9
3n8xB-4ph9A:
64.31
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.
4qiw DNA-DIRECTED RNA
POLYMERASE


(Thermococcus
kodakarensis)
PF00562
(RNA_pol_Rpb2_6)
PF04560
(RNA_pol_Rpb2_7)
PF04561
(RNA_pol_Rpb2_2)
PF04563
(RNA_pol_Rpb2_1)
PF04565
(RNA_pol_Rpb2_3)
PF04566
(RNA_pol_Rpb2_4)
PF04567
(RNA_pol_Rpb2_5)
3 VAL B 868
VAL B 806
SER B 804
None
0.74A 3n8xB-4qiwB:
undetectable
3n8xB-4qiwB:
19.86
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.
4qti ANTI-UPAR ANTIBODY,
HEAVY CHAIN


(Mus musculus)
PF07654
(C1-set)
PF07686
(V-set)
3 VAL H 202
VAL H 172
SER H 170
None
0.73A 3n8xB-4qtiH:
undetectable
3n8xB-4qtiH:
14.34
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.
4u28 PHOSPHORIBOSYL
ISOMERASE A


(Streptomyces
sviceus)
PF00977
(His_biosynth)
3 VAL A  56
VAL A 168
SER A 200
None
None
PO4  A 301 ( 4.4A)
0.73A 3n8xB-4u28A:
undetectable
3n8xB-4u28A:
16.55
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.
4wvm STONUSTOXIN SUBUNIT
BETA


(Synanceia
horrida)
PF00622
(SPRY)
PF13765
(PRY)
3 VAL B   8
VAL B  84
SER B  78
None
0.73A 3n8xB-4wvmB:
undetectable
3n8xB-4wvmB:
21.55
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.
4x2r 1-(5-PHOSPHORIBOSYL)
-5-[(5-PHOSPHORIBOSY
LAMINO)METHYLIDENEAM
INO]
IMIDAZOLE-4-CARBOXAM
IDE ISOMERASE


(Actinomyces
urogenitalis)
PF00977
(His_biosynth)
3 VAL A  50
VAL A 162
SER A 194
PO4  A 303 (-4.7A)
None
PO4  A 303 ( 4.2A)
0.70A 3n8xB-4x2rA:
undetectable
3n8xB-4x2rA:
18.35
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.
4x3m RNA 2'-O RIBOSE
METHYLTRANSFERASE


(Thermus
thermophilus)
PF00588
(SpoU_methylase)
3 VAL A 164
VAL A 151
SER A 155
None
0.70A 3n8xB-4x3mA:
undetectable
3n8xB-4x3mA:
19.84
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.
4x9s PHOSPHORIBOSYL
ISOMERASE A


(Streptomyces
sp. Mg1)
PF00977
(His_biosynth)
3 VAL A  54
VAL A 166
SER A 198
SO4  A 305 (-4.8A)
None
SO4  A 305 ( 4.3A)
0.73A 3n8xB-4x9sA:
undetectable
3n8xB-4x9sA:
17.42
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.
4zpi PUTATIVE
OXIDASE/HYDROXYLASE


(Streptomyces
hygroscopicus)
PF05721
(PhyH)
3 VAL A 257
VAL A 180
SER A 182
None
0.70A 3n8xB-4zpiA:
undetectable
3n8xB-4zpiA:
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.
5bp1 MYCOCEROSIC ACID
SYNTHASE


(Mycolicibacterium
smegmatis)
PF00109
(ketoacyl-synt)
PF00698
(Acyl_transf_1)
PF02801
(Ketoacyl-synt_C)
PF16197
(KAsynt_C_assoc)
3 VAL A 737
VAL A 690
SER A 692
None
0.70A 3n8xB-5bp1A:
undetectable
3n8xB-5bp1A:
20.58
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.
5dmh UNCHARACTERIZED
PROTEIN CONSERVED IN
BACTERIA


(Cupriavidus
necator)
PF07005
(DUF1537)
PF17042
(DUF1357_C)
3 VAL A 347
VAL A 331
SER A 326
ADP  A 501 (-3.8A)
ADP  A 501 ( 3.9A)
ADP  A 501 (-2.7A)
0.70A 3n8xB-5dmhA:
undetectable
3n8xB-5dmhA:
22.09
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.
5ewr BOX C/D SNORNP AND
U4 SNRNP COMPONENT
SNU13P


(Cyanidioschyzon
merolae)
PF01248
(Ribosomal_L7Ae)
3 VAL A 116
VAL A  43
SER A  47
None
0.69A 3n8xB-5ewrA:
undetectable
3n8xB-5ewrA:
13.86
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.
5fzo PROBABLE JMJC
DOMAIN-CONTAINING
HISTONE
DEMETHYLATION PROT
EIN 2C


(Homo sapiens)
PF02373
(JmjC)
3 VAL A2477
VAL A2197
SER A2284
None
0.68A 3n8xB-5fzoA:
undetectable
3n8xB-5fzoA:
22.20
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.
5gaf SIGNAL RECOGNITION
PARTICLE PROTEIN


(Escherichia
coli)
PF00466
(Ribosomal_L10)
3 VAL i 208
VAL i 135
SER i 162
None
0.62A 3n8xB-5gafi:
3.0
3n8xB-5gafi:
21.64
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.
5h5b THYMIDYLATE KINASE

(Aquifex
aeolicus)
no annotation 3 VAL B 170
VAL B 192
SER B 190
None
0.74A 3n8xB-5h5bB:
undetectable
3n8xB-5h5bB:
17.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5ikr PROSTAGLANDIN G/H
SYNTHASE 2


(Homo sapiens)
PF00008
(EGF)
PF03098
(An_peroxidase)
3 VAL A 116
VAL A 349
SER A 353
None
ID8  A 601 (-3.9A)
ID8  A 601 ( 4.7A)
0.19A 3n8xB-5ikrA:
58.3
3n8xB-5ikrA:
63.88
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.
5kte DIVALENT METAL
CATION TRANSPORTER
MNTH


(Deinococcus
radiodurans)
PF01566
(Nramp)
3 VAL A 179
VAL A 330
SER A 328
None
0.64A 3n8xB-5kteA:
undetectable
3n8xB-5kteA:
20.63
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.
5lnq 3-KETOACYL-COA
THIOLASE-LIKE
PROTEIN


(Leishmania
mexicana)
PF00108
(Thiolase_N)
PF02803
(Thiolase_C)
3 VAL A  73
VAL A  18
SER A  64
None
0.65A 3n8xB-5lnqA:
undetectable
3n8xB-5lnqA:
21.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5n29 CTP SYNTHASE

(Trypanosoma
brucei)
PF00117
(GATase)
3 VAL A 424
VAL A 330
SER A 366
None
None
CL  A 602 (-3.3A)
0.72A 3n8xB-5n29A:
undetectable
3n8xB-5n29A:
17.63
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.
5o0j ADP-DEPENDENT
GLUCOKINASE


(Pyrococcus
horikoshii)
no annotation 3 VAL A 190
VAL A  59
SER A  63
None
0.66A 3n8xB-5o0jA:
0.7
3n8xB-5o0jA:
10.76
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.
5uja BOVINE MULTIDRUG
RESISTANCE PROTEIN 1
(MRP1),MULTIDRUG
RESISTANCE-ASSOCIATE
D PROTEIN 1


(Bos taurus)
PF00005
(ABC_tran)
PF00664
(ABC_membrane)
3 VAL A 254
VAL A1181
SER A1177
None
0.74A 3n8xB-5ujaA:
undetectable
3n8xB-5ujaA:
16.29
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.
5vhs 26S PROTEASOME
NON-ATPASE
REGULATORY SUBUNIT 3


(Homo sapiens)
PF01399
(PCI)
PF08375
(Rpn3_C)
3 VAL V 438
VAL V 458
SER V 460
None
0.52A 3n8xB-5vhsV:
undetectable
3n8xB-5vhsV:
20.85
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.
5w7a ACYLOXYACYL
HYDROLASE LARGE
SUBUNIT
ACYLOXYACYL
HYDROLASE SMALL
SUBUNIT


(Oryctolagus
cuniculus)
no annotation 3 VAL B 442
VAL A  44
SER A  48
None
0.66A 3n8xB-5w7aB:
undetectable
3n8xB-5w7aB:
8.32
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.
5x18 CASEIN KINASE I
HOMOLOG 1


(Saccharomyces
cerevisiae)
PF00069
(Pkinase)
3 VAL A 299
VAL A 317
SER A 319
None
0.73A 3n8xB-5x18A:
undetectable
3n8xB-5x18A:
20.73
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.
5xei CHROMOSOME PARTITION
PROTEIN SMC


(Pyrococcus
yayanosii)
PF02463
(SMC_N)
3 VAL A  20
VAL A1149
SER A  14
None
0.55A 3n8xB-5xeiA:
2.6
3n8xB-5xeiA:
20.55
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.
5xqw FAB FRAGMENT OF
CATALYTIC ANTIBODY
7B9, HEAVY CHAIN
FAB FRAGMENT OF
CATALYTIC ANTIBODY
7B9, LIGHT CHAIN


(Mus musculus)
no annotation 3 VAL L  89
VAL H  93
SER H  95
8EU  H 301 ( 4.8A)
8EU  H 301 ( 4.7A)
8EU  H 301 (-2.7A)
0.52A 3n8xB-5xqwL:
undetectable
3n8xB-5xqwL:
10.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5yq3 AT3G55470

(Arabidopsis
thaliana)
no annotation 3 VAL A  76
VAL A 125
SER A 123
None
0.64A 3n8xB-5yq3A:
undetectable
3n8xB-5yq3A:
10.13
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.
6bcq TRANSIENT RECEPTOR
POTENTIAL CATION
CHANNEL SUBFAMILY M
MEMBER 4


(Mus musculus)
no annotation 3 VAL B 672
VAL B 586
SER B 623
None
0.57A 3n8xB-6bcqB:
undetectable
3n8xB-6bcqB:
8.32
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.
6fik POLYKETIDE SYNTHASE

(Cercospora
nicotianae)
no annotation 3 VAL A 276
VAL A 289
SER A 282
None
0.74A 3n8xB-6fikA:
undetectable
3n8xB-6fikA:
9.63