SIMILAR PATTERNS OF AMINO ACIDS FOR 3KMO_B_EAAB213_1

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.
1b33 ALLOPHYCOCYANIN,
ALPHA CHAIN


(Mastigocladus
laminosus)
PF00502
(Phycobilisome)
4 TYR A 115
VAL A 111
VAL A 155
GLY A 107
None
None
None
BLA  A 201 ( 4.0A)
1.15A 3kmoB-1b33A:
1.0
3kmoB-1b33A:
24.04
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.
1bhe POLYGALACTURONASE

(Pectobacterium
carotovorum)
PF00295
(Glyco_hydro_28)
4 VAL A 304
VAL A 299
ASN A 277
GLY A 278
None
0.84A 3kmoB-1bheA:
undetectable
3kmoB-1bheA:
17.32
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.
1ebd DIHYDROLIPOAMIDE
DEHYDROGENASE


(Geobacillus
stearothermophilus)
PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2)
4 TYR A 138
VAL A 129
ASN A 131
GLY A 117
None
0.97A 3kmoB-1ebdA:
undetectable
3kmoB-1ebdA:
19.64
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.
1ece ENDOCELLULASE E1

(Acidothermus
cellulolyticus)
PF00150
(Cellulase)
4 TYR A 235
VAL A 203
TRP A 178
GLY A 219
None
0.99A 3kmoB-1eceA:
undetectable
3kmoB-1eceA:
16.57
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.
1g3r CELL DIVISION
INHIBITOR


(Pyrococcus
furiosus)
PF13614
(AAA_31)
4 PHE A 114
VAL A  34
ASN A  80
GLY A  28
None
1.01A 3kmoB-1g3rA:
undetectable
3kmoB-1g3rA:
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.
1h0h FORMATE
DEHYDROGENASE
SUBUNIT ALPHA


(Desulfovibrio
gigas)
PF00384
(Molybdopterin)
PF01568
(Molydop_binding)
PF04879
(Molybdop_Fe4S4)
4 TYR A 750
VAL A 757
ASN A 746
GLY A 747
None
0.98A 3kmoB-1h0hA:
undetectable
3kmoB-1h0hA:
12.44
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.
1hzh IMMUNOGLOBULIN HEAVY
CHAIN


(Homo sapiens)
PF07654
(C1-set)
PF07686
(V-set)
4 VAL H 102
TRP H 103
ASN H 100
GLY H  96
None
1.13A 3kmoB-1hzhH:
undetectable
3kmoB-1hzhH:
18.44
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.
1ig8 HEXOKINASE PII

(Saccharomyces
cerevisiae)
PF00349
(Hexokinase_1)
PF03727
(Hexokinase_2)
4 PHE A 232
VAL A 420
VAL A 236
GLY A 307
None
0.94A 3kmoB-1ig8A:
undetectable
3kmoB-1ig8A:
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.
1ion PROBABLE CELL
DIVISION INHIBITOR
MIND


(Pyrococcus
horikoshii)
PF13614
(AAA_31)
4 PHE A 114
VAL A  34
ASN A  80
GLY A  28
None
1.02A 3kmoB-1ionA:
undetectable
3kmoB-1ionA:
23.31
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.
1k5s PENICILLIN G ACYLASE
BETA SUBUNIT


(Escherichia
coli)
PF01804
(Penicil_amidase)
4 TYR B 230
VAL B   5
ASN B 185
GLY B 186
None
1.15A 3kmoB-1k5sB:
undetectable
3kmoB-1k5sB:
15.87
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.
1kh2 ARGININOSUCCINATE
SYNTHETASE


(Thermus
thermophilus)
PF00764
(Arginosuc_synth)
4 TYR A 279
VAL A  79
VAL A 254
GLY A  82
None
0.89A 3kmoB-1kh2A:
undetectable
3kmoB-1kh2A:
22.42
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1lbk GLUTATHIONE
S-TRANSFERASE CLASS
PI CHIMAERA (CODA)


(Homo sapiens)
PF02798
(GST_N)
PF14497
(GST_C_3)
5 TYR A   7
PHE A   8
VAL A  10
VAL A  35
TRP A  38
None
GSH  A 504 (-4.7A)
None
None
GSH  A 504 (-3.9A)
0.19A 3kmoB-1lbkA:
35.6
3kmoB-1lbkA:
96.15
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.
1m0u GST2 GENE PRODUCT

(Drosophila
melanogaster)
PF02798
(GST_N)
PF14497
(GST_C_3)
4 TYR A  54
PHE A  55
VAL A  57
TRP A  85
GSH  A 500 (-4.7A)
GSH  A 500 (-4.8A)
None
GSH  A 500 (-3.6A)
0.49A 3kmoB-1m0uA:
22.8
3kmoB-1m0uA:
25.00
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.
1q7l AMINOACYLASE-1

(Homo sapiens)
PF01546
(Peptidase_M20)
4 PHE A 158
VAL A  54
VAL A 159
GLY A 154
None
0.94A 3kmoB-1q7lA:
undetectable
3kmoB-1q7lA:
21.93
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.
1r6v SUBTILISIN-LIKE
SERINE PROTEASE


(Fervidobacterium
pennivorans)
PF00082
(Peptidase_S8)
4 VAL A  56
VAL A  64
ASN A  60
GLY A  61
None
1.12A 3kmoB-1r6vA:
undetectable
3kmoB-1r6vA:
15.11
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.
1rcl RIBONUCLEASE F1

(Fusarium
fujikuroi)
PF00545
(Ribonuclease)
4 TYR A  42
VAL A  78
VAL A  52
GLY A  87
None
1.03A 3kmoB-1rclA:
undetectable
3kmoB-1rclA:
17.37
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.
1sgf NERVE GROWTH FACTOR

(Mus musculus)
PF00089
(Trypsin)
4 TYR G  40
VAL G  66
TRP G  67
GLY G  44
None
0.70A 3kmoB-1sgfG:
undetectable
3kmoB-1sgfG:
22.35
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1tu7 GLUTATHIONE
S-TRANSFERASE 2


(Onchocerca
volvulus)
PF02798
(GST_N)
PF14497
(GST_C_3)
4 TYR A   7
PHE A   8
ASN A 203
GLY A 204
None
GSH  A1001 (-4.8A)
None
None
0.38A 3kmoB-1tu7A:
30.4
3kmoB-1tu7A:
41.43
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.
1uag UDP-N-ACETYLMURAMOYL
-L-ALANINE/:D-GLUTAM
ATE LIGASE


(Escherichia
coli)
PF02875
(Mur_ligase_C)
PF08245
(Mur_ligase_M)
4 VAL A 335
VAL A 312
ASN A 363
GLY A 337
None
1.10A 3kmoB-1uagA:
undetectable
3kmoB-1uagA:
20.56
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.
1vjg PUTATIVE LIPASE FROM
THE G-D-S-L FAMILY


(Nostoc sp. PCC
7120)
PF13472
(Lipase_GDSL_2)
4 TYR A  47
PHE A  13
ASN A  20
GLY A  51
None
0.97A 3kmoB-1vjgA:
undetectable
3kmoB-1vjgA:
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.
1wno CHITINASE

(Aspergillus
fumigatus)
PF00704
(Glyco_hydro_18)
4 TYR A 275
PHE A 265
VAL A 278
GLY A 286
None
1.07A 3kmoB-1wnoA:
undetectable
3kmoB-1wnoA:
22.59
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.
1xqp 8-OXOGUANINE DNA
GLYCOSYLASE


(Pyrobaculum
aerophilum)
PF09171
(AGOG)
4 PHE A  76
VAL A  38
VAL A  81
GLY A  47
None
0.79A 3kmoB-1xqpA:
undetectable
3kmoB-1xqpA:
21.34
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.
2a5h L-LYSINE
2,3-AMINOMUTASE


(Clostridium
subterminale)
PF04055
(Radical_SAM)
PF12544
(LAM_C)
4 VAL A 284
VAL A 253
ASN A 257
GLY A 256
None
1.13A 3kmoB-2a5hA:
undetectable
3kmoB-2a5hA:
18.29
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.
2bji INOSITOL-1(OR
4)-MONOPHOSPHATASE


(Bos taurus)
PF00459
(Inositol_P)
4 PHE A1098
VAL A1105
VAL A1099
GLY A1094
None
1.04A 3kmoB-2bjiA:
undetectable
3kmoB-2bjiA:
20.14
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.
2dba SMOOTH MUSCLE CELL
ASSOCIATED
PROTEIN-1, ISOFORM 2


(Homo sapiens)
PF07719
(TPR_2)
PF13432
(TPR_16)
4 TYR A 103
PHE A 135
VAL A 126
ASN A 141
None
1.14A 3kmoB-2dbaA:
undetectable
3kmoB-2dbaA:
26.07
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.
2ddh ACYL-COA OXIDASE

(Rattus
norvegicus)
PF01756
(ACOX)
PF02770
(Acyl-CoA_dh_M)
PF14749
(Acyl-CoA_ox_N)
4 PHE A 341
VAL A 344
ASN A 288
GLY A 287
None
1.07A 3kmoB-2ddhA:
undetectable
3kmoB-2ddhA:
15.00
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.
2dy3 ALANINE RACEMASE

(Corynebacterium
glutamicum)
PF00842
(Ala_racemase_C)
PF01168
(Ala_racemase_N)
4 PHE A 327
VAL A 325
ASN A 330
GLY A 331
None
0.94A 3kmoB-2dy3A:
undetectable
3kmoB-2dy3A:
19.83
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.
2eta TRANSIENT RECEPTOR
POTENTIAL CATION
CHANNEL SUBFAMILY V
MEMBER 2


(Rattus
norvegicus)
PF12796
(Ank_2)
4 VAL A 153
VAL A 190
ASN A 186
GLY A 187
None
1.09A 3kmoB-2etaA:
undetectable
3kmoB-2etaA:
22.57
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.
2f37 TRANSIENT RECEPTOR
POTENTIAL CATION
CHANNEL SUBFAMILY V
MEMBER 2


(Homo sapiens)
PF12796
(Ank_2)
4 VAL A 152
VAL A 189
ASN A 185
GLY A 186
None
1.03A 3kmoB-2f37A:
undetectable
3kmoB-2f37A:
22.26
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2gsr CLASS PI GST
GLUTATHIONE
S-TRANSFERASE


(Sus scrofa)
PF02798
(GST_N)
PF14497
(GST_C_3)
6 TYR A   7
PHE A   8
VAL A  10
TRP A  38
ASN A 202
GLY A 203
GTS  A 208 (-4.5A)
GTS  A 208 (-4.7A)
None
GTS  A 208 (-3.9A)
None
None
0.23A 3kmoB-2gsrA:
35.4
3kmoB-2gsrA:
81.82
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.
2qve TYROSINE AMINOMUTASE

(Streptomyces
globisporus)
PF00221
(Lyase_aromatic)
4 TYR A 494
PHE A 483
VAL A 477
GLY A 481
None
1.11A 3kmoB-2qveA:
undetectable
3kmoB-2qveA:
17.82
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.
2w1q HYALURONOGLUCOSAMINI
DASE


(Clostridium
perfringens)
PF00754
(F5_F8_type_C)
4 TYR A 837
VAL A 818
ASN A 822
GLY A 821
None
1.11A 3kmoB-2w1qA:
undetectable
3kmoB-2w1qA:
23.40
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.
2x0s PYRUVATE PHOSPHATE
DIKINASE


(Trypanosoma
brucei)
PF00391
(PEP-utilizers)
PF01326
(PPDK_N)
PF02896
(PEP-utilizers_C)
4 PHE A   9
VAL A  35
ASN A  13
GLY A  11
None
1.00A 3kmoB-2x0sA:
undetectable
3kmoB-2x0sA:
12.92
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.
2x8x TLR1789 PROTEIN

(Thermosynechococcus
elongatus)
PF07244
(POTRA)
PF08479
(POTRA_2)
4 TYR X 189
VAL X 215
VAL X 219
GLY X 152
None
0.88A 3kmoB-2x8xX:
undetectable
3kmoB-2x8xX:
21.54
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.
2y4l MANNOSYLGLYCERATE
SYNTHASE


(Rhodothermus
marinus)
no annotation 4 TYR A 366
VAL A 355
TRP A 140
ASN A 350
None
None
None
EDO  A 503 (-4.0A)
1.10A 3kmoB-2y4lA:
undetectable
3kmoB-2y4lA:
20.67
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.
2y6i COLLAGENASE

(Hathewaya
histolytica)
PF01752
(Peptidase_M9)
PF08453
(Peptidase_M9_N)
4 TYR A 439
PHE A 417
ASN A 419
GLY A 420
None
1.13A 3kmoB-2y6iA:
2.0
3kmoB-2y6iA:
12.66
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.
2yyt OROTIDINE
5'-PHOSPHATE
DECARBOXYLASE


(Geobacillus
kaustophilus)
PF00215
(OMPdecase)
4 TYR A  40
VAL A  48
VAL A  86
GLY A  82
None
0.99A 3kmoB-2yytA:
undetectable
3kmoB-2yytA:
23.92
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.
3h3b RECEPTOR
TYROSINE-PROTEIN
KINASE ERBB-2


(Homo sapiens)
PF01030
(Recep_L_domain)
4 TYR A  28
VAL A   3
ASN A  37
GLY A  36
None
1.15A 3kmoB-3h3bA:
undetectable
3kmoB-3h3bA:
22.83
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.
3hg0 DESIGNED ANKYRIN
REPEAT PROTEIN
(DARPIN) 20


(synthetic
construct)
PF13857
(Ank_5)
4 VAL D  40
VAL D  73
ASN D  69
GLY D  70
None
0.95A 3kmoB-3hg0D:
undetectable
3kmoB-3hg0D:
20.56
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.
3hzh CHEMOTAXIS OPERON
PROTEIN (CHEX)


(Borreliella
burgdorferi)
PF13690
(CheX)
4 VAL B  47
VAL B 153
ASN B  99
GLY B  98
None
None
BFD  A  79 ( 3.2A)
None
0.64A 3kmoB-3hzhB:
undetectable
3kmoB-3hzhB:
21.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3jcu OXYGEN-EVOLVING
ENHANCER PROTEIN 2,
CHLOROPLASTIC


(Spinacia
oleracea)
PF01789
(PsbP)
4 TYR P  49
VAL P  46
ASN P  22
GLY P  23
None
1.11A 3kmoB-3jcuP:
undetectable
3kmoB-3jcuP:
21.58
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.
3juy 3B3 SINGLE CHAIN
VARIANT HIV-1
ANTIBODY


(Homo sapiens)
no annotation 4 VAL B 116
TRP B 117
ASN B 111
GLY B 100
None
1.13A 3kmoB-3juyB:
undetectable
3kmoB-3juyB:
22.96
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.
3ldr FRUCTOSYLTRANSFERASE

(Aspergillus
japonicus)
PF00251
(Glyco_hydro_32N)
PF08244
(Glyco_hydro_32C)
4 PHE A 577
VAL A 579
VAL A 441
ASN A 434
None
0.95A 3kmoB-3ldrA:
undetectable
3kmoB-3ldrA:
16.01
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.
3lpd ACIDIC EXTRACELLULAR
SUBTILISIN-LIKE
PROTEASE APRV2


(Dichelobacter
nodosus)
PF00082
(Peptidase_S8)
4 TYR A  14
VAL A 126
VAL A 330
GLY A 285
None
1.04A 3kmoB-3lpdA:
undetectable
3kmoB-3lpdA:
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.
3lqw DEOXYURIDINE
5'-TRIPHOSPHATE
NUCLEOTIDOHYDROLASE


(Entamoeba
histolytica)
PF00692
(dUTPase)
4 PHE A  43
VAL A  45
ASN A 101
GLY A 102
None
0.93A 3kmoB-3lqwA:
undetectable
3kmoB-3lqwA:
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.
3n2o BIOSYNTHETIC
ARGININE
DECARBOXYLASE


(Vibrio
vulnificus)
PF02784
(Orn_Arg_deC_N)
4 TYR A 277
PHE A 290
VAL A 292
ASN A  96
None
1.06A 3kmoB-3n2oA:
undetectable
3kmoB-3n2oA:
17.48
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.
3nkg UNCHARACTERIZED
PROTEIN
GEBA250068378


(Sulfurospirillum
deleyianum)
no annotation 4 TYR A  88
VAL A  94
ASN A 123
GLY A 122
None
None
ACY  A 175 (-3.1A)
None
1.14A 3kmoB-3nkgA:
undetectable
3kmoB-3nkgA:
20.19
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.
3nqx SECRETED
METALLOPROTEASE
MCP02


(Pseudoalteromonas
sp. SM9913)
PF01447
(Peptidase_M4)
PF02868
(Peptidase_M4_C)
4 TYR A 434
VAL A 455
ASN A 475
GLY A 476
None
1.15A 3kmoB-3nqxA:
undetectable
3kmoB-3nqxA:
21.25
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.
3nyf D-ARGININE
DEHYDROGENASE


(Pseudomonas
aeruginosa)
PF01266
(DAO)
4 TYR A1317
PHE A1325
VAL A1194
VAL A1327
None
0.99A 3kmoB-3nyfA:
undetectable
3kmoB-3nyfA:
20.57
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3o76 GLUTATHIONE
S-TRANSFERASE P 1


(Mus musculus)
PF02798
(GST_N)
PF14497
(GST_C_3)
6 TYR A   7
PHE A   8
VAL A  10
TRP A  38
ASN A 204
GLY A 205
None
GTB  A 210 (-4.5A)
None
GTB  A 210 (-4.0A)
None
GTB  A 210 (-3.7A)
0.35A 3kmoB-3o76A:
36.2
3kmoB-3o76A:
84.21
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.
3ti7 BASIC EXTRACELLULAR
SUBTILISIN-LIKE
PROTEASE BPRV


(Dichelobacter
nodosus)
PF00082
(Peptidase_S8)
4 TYR A  14
VAL A 126
VAL A 330
GLY A 285
None
0.99A 3kmoB-3ti7A:
undetectable
3kmoB-3ti7A:
20.12
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.
3u62 SHIKIMATE
DEHYDROGENASE


(Thermotoga
maritima)
PF01488
(Shikimate_DH)
PF08501
(Shikimate_dh_N)
4 VAL A 137
VAL A 123
ASN A 139
GLY A 115
None
None
SO4  A 503 (-3.8A)
SO4  A 503 (-3.5A)
0.98A 3kmoB-3u62A:
undetectable
3kmoB-3u62A:
20.69
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3vpq GLUTATHIONE
S-TRANSFERASE SIGMA


(Bombyx mori)
PF02798
(GST_N)
PF14497
(GST_C_3)
4 TYR A   8
PHE A   9
VAL A  11
TRP A  39
GSH  A 301 (-4.3A)
GSH  A 301 (-4.3A)
None
GSH  A 301 (-3.5A)
0.36A 3kmoB-3vpqA:
20.4
3kmoB-3vpqA:
31.53
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.
3wbn PUTATIVE
UNCHARACTERIZED
PROTEIN


(Pyrococcus
furiosus)
PF01554
(MatE)
4 VAL A 278
VAL A 425
ASN A 274
GLY A 275
None
0.93A 3kmoB-3wbnA:
undetectable
3kmoB-3wbnA:
17.78
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.
3zo0 E3 UBIQUITIN-PROTEIN
LIGASE TRIM21


(Mus musculus)
PF00622
(SPRY)
PF13765
(PRY)
4 VAL B  85
VAL B  80
ASN B  97
GLY B  98
None
1.00A 3kmoB-3zo0B:
undetectable
3kmoB-3zo0B:
22.67
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.
4ar9 COLLAGENASE COLT

(Clostridium
tetani)
PF01752
(Peptidase_M9)
4 TYR A 381
PHE A 359
ASN A 361
GLY A 362
None
1.13A 3kmoB-4ar9A:
undetectable
3kmoB-4ar9A:
18.94
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.
4are COLLAGENASE G

(Hathewaya
histolytica)
PF01752
(Peptidase_M9)
PF08453
(Peptidase_M9_N)
4 TYR A 439
PHE A 417
ASN A 419
GLY A 420
None
1.11A 3kmoB-4areA:
2.6
3kmoB-4areA:
15.25
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.
4bq4 B-AGARASE

(Saccharophagus
degradans)
PF02449
(Glyco_hydro_42)
4 VAL A 516
VAL A 629
ASN A 477
GLY A 478
None
1.09A 3kmoB-4bq4A:
undetectable
3kmoB-4bq4A:
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.
4hrl DESIGNED ANKYRIN
REPEAT PROTEIN 9_29


(synthetic
construct)
PF12796
(Ank_2)
4 VAL A 105
VAL A 138
ASN A 134
GLY A 135
None
1.04A 3kmoB-4hrlA:
undetectable
3kmoB-4hrlA:
19.53
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.
4i84 HEME/HEMOPEXIN-BINDI
NG PROTEIN


(Haemophilus
influenzae)
PF05860
(Haemagg_act)
4 PHE A 148
VAL A 149
ASN A 167
GLY A 168
None
1.13A 3kmoB-4i84A:
undetectable
3kmoB-4i84A:
21.34
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.
4jmh CLAMP SHC1_PY239/240

(synthetic
construct)
PF00017
(SH2)
PF00041
(fn3)
4 PHE A  63
VAL A  79
TRP A  40
GLY A  61
None
1.03A 3kmoB-4jmhA:
undetectable
3kmoB-4jmhA:
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.
4mqd DNA-ENTRY NUCLEASE
INHIBITOR


(Bacillus
subtilis)
PF11033
(ComJ)
4 TYR A 106
VAL A  82
ASN A  85
GLY A  86
None
0.94A 3kmoB-4mqdA:
undetectable
3kmoB-4mqdA:
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.
4nsp ENDONUCLEASE V

(Homo sapiens)
PF04493
(Endonuclease_5)
4 PHE A 136
VAL A  28
ASN A 128
GLY A 129
None
0.92A 3kmoB-4nspA:
undetectable
3kmoB-4nspA:
22.10
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.
4of7 PROTEIN SYG-1,
ISOFORM B


(Caenorhabditis
elegans)
PF07679
(I-set)
4 VAL A  53
TRP A  55
ASN A  84
GLY A  85
None
1.13A 3kmoB-4of7A:
undetectable
3kmoB-4of7A:
21.81
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.
4pkl BROMODOMAIN FACTOR 2

(Trypanosoma
brucei)
PF00439
(Bromodomain)
4 PHE A  18
VAL A  19
ASN A  11
GLY A  14
None
1.12A 3kmoB-4pklA:
undetectable
3kmoB-4pklA:
19.53
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.
4r40 PROTEIN TOLB

(Yersinia pestis)
PF04052
(TolB_N)
PF07676
(PD40)
4 TYR A 169
VAL A 171
VAL A 400
GLY A 419
None
0.92A 3kmoB-4r40A:
undetectable
3kmoB-4r40A:
20.05
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.
4rmp ALLOPHYCOCYANIN

(Phormidium
rubidum)
PF00502
(Phycobilisome)
4 TYR A 116
VAL A 112
VAL A 156
GLY A 108
None
None
None
CYC  A 201 ( 3.8A)
1.13A 3kmoB-4rmpA:
undetectable
3kmoB-4rmpA:
26.51
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.
4ru4 TAIL SPIKE PROTEIN
GP49


(Pseudomonas
virus LKA1)
PF13229
(Beta_helix)
4 TYR A 707
PHE A 703
VAL A 701
GLY A 683
None
0.89A 3kmoB-4ru4A:
undetectable
3kmoB-4ru4A:
18.04
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.
4udn PERIPLASMIC SOLUTE
BINDING PROTEIN


(Candidatus
Liberibacter
asiaticus)
PF01297
(ZnuA)
4 TYR A 177
VAL A 176
VAL A 246
GLY A 173
None
0.95A 3kmoB-4udnA:
undetectable
3kmoB-4udnA:
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.
4w66 GLUTATHIONE
S-TRANSFERASE DOMAIN
PROTEIN


(Haliangium
ochraceum)
PF14497
(GST_C_3)
4 TYR A   9
PHE A  10
VAL A  12
TRP A  40
None
0.35A 3kmoB-4w66A:
21.4
3kmoB-4w66A:
27.02
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.
4x8f RIBOKINASE

(Vibrio cholerae)
PF00294
(PfkB)
4 VAL A 259
VAL A  55
ASN A 255
GLY A 256
None
0.95A 3kmoB-4x8fA:
undetectable
3kmoB-4x8fA:
23.25
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.
5aoy ENDONUCLEASE V

(Mus musculus)
PF04493
(Endonuclease_5)
4 PHE A 136
VAL A  28
ASN A 128
GLY A 129
None
0.82A 3kmoB-5aoyA:
undetectable
3kmoB-5aoyA:
23.55
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.
5bqt PUTATIVE HTH-TYPE
TRANSCRIPTIONAL
REGULATOR TRMBL2


(Pyrococcus
furiosus)
PF01978
(TrmB)
PF11495
(Regulator_TrmB)
4 TYR A  24
PHE A  61
VAL A  75
ASN A  79
None
0.99A 3kmoB-5bqtA:
undetectable
3kmoB-5bqtA:
21.97
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.
5d6n ACYL-COA SYNTHASE

(Mycolicibacterium
smegmatis)
PF00501
(AMP-binding)
4 VAL A  66
VAL A  80
ASN A  63
GLY A  96
None
1.14A 3kmoB-5d6nA:
undetectable
3kmoB-5d6nA:
18.26
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5d73 GLUTATHIONE
S-TRANSFERASE


(Wuchereria
bancrofti)
PF02798
(GST_N)
PF14497
(GST_C_3)
5 TYR A   7
PHE A   8
TRP A  38
ASN A 203
GLY A 204
None
GSH  A 301 (-4.9A)
GSH  A 301 (-4.0A)
None
None
0.46A 3kmoB-5d73A:
30.5
3kmoB-5d73A:
41.90
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.
5eef HDAC6

(Danio rerio)
PF00850
(Hist_deacetyl)
4 VAL A 175
VAL A 168
ASN A 182
GLY A 183
None
None
EDO  A2006 ( 4.1A)
None
1.07A 3kmoB-5eefA:
undetectable
3kmoB-5eefA:
20.49
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.
5ewo STRUCTURAL PROTEIN

(Mamastrovirus 1)
PF12226
(Astro_capsid_p)
4 TYR A 588
PHE A 582
VAL A 543
GLY A 546
None
0.94A 3kmoB-5ewoA:
undetectable
3kmoB-5ewoA:
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.
5ey8 ACYL-COA SYNTHASE

(Mycolicibacterium
smegmatis)
PF00501
(AMP-binding)
4 VAL A  66
VAL A  80
ASN A  63
GLY A  96
None
1.10A 3kmoB-5ey8A:
undetectable
3kmoB-5ey8A:
16.21
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.
5ham RICKCE

(Rickettsia
bellii)
no annotation 4 VAL A 566
VAL A 446
ASN A 635
GLY A 636
None
0.90A 3kmoB-5hamA:
undetectable
3kmoB-5hamA:
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.
5jgp NITRATE/NITRITE
SENSOR PROTEIN NARQ


(Escherichia
coli)
PF00672
(HAMP)
PF13675
(PilJ)
4 TYR A  90
VAL A  88
VAL A  95
ASN A  85
None
1.15A 3kmoB-5jgpA:
undetectable
3kmoB-5jgpA:
24.22
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.
5k1c WD REPEAT-CONTAINING
PROTEIN 20


(Homo sapiens)
PF00400
(WD40)
4 TYR C  74
VAL C  69
VAL C  50
GLY C 553
None
1.14A 3kmoB-5k1cC:
undetectable
3kmoB-5k1cC:
16.46
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.
5leb DDD_D12_06_D12_06_D1
2


(synthetic
construct)
PF12796
(Ank_2)
PF13857
(Ank_5)
4 VAL A 106
VAL A 139
ASN A 135
GLY A 136
None
1.03A 3kmoB-5lebA:
undetectable
3kmoB-5lebA:
18.90
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.
5leb DDD_D12_06_D12_06_D1
2


(synthetic
construct)
PF12796
(Ank_2)
PF13857
(Ank_5)
4 VAL A 225
VAL A 258
ASN A 254
GLY A 255
None
1.11A 3kmoB-5lebA:
undetectable
3kmoB-5lebA:
18.90
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.
5lw2 DARPIN_5M3_D12

(synthetic
construct)
PF12796
(Ank_2)
4 VAL A 106
VAL A 139
ASN A 135
GLY A 136
None
1.00A 3kmoB-5lw2A:
undetectable
3kmoB-5lw2A:
22.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5mad 3G61

(synthetic
construct)
no annotation 4 VAL A 105
VAL A 138
ASN A 134
GLY A 135
None
1.01A 3kmoB-5madA:
undetectable
3kmoB-5madA:
18.10
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.
5mak R7

(synthetic
construct)
no annotation 4 VAL A 243
VAL A 276
ASN A 272
GLY A 273
None
0.94A 3kmoB-5makA:
undetectable
3kmoB-5makA:
25.73
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.
5mqs BETA-L-ARABINOBIOSID
ASE


(Bacteroides
thetaiotaomicron)
PF13088
(BNR_2)
4 VAL A 189
VAL A 123
ASN A 169
GLY A 168
None
0.84A 3kmoB-5mqsA:
2.0
3kmoB-5mqsA:
12.38
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.
5n6u BETA-MANNOSIDASE

(Dictyoglomus
thermophilum)
PF00703
(Glyco_hydro_2)
PF02837
(Glyco_hydro_2_N)
4 TYR A 553
PHE A 495
VAL A 488
GLY A 497
None
1.13A 3kmoB-5n6uA:
undetectable
3kmoB-5n6uA:
13.10
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.
5nkp KELCH-LIKE PROTEIN 3

(Homo sapiens)
PF01344
(Kelch_1)
4 TYR A 444
VAL A 439
VAL A 509
GLY A 490
None
1.10A 3kmoB-5nkpA:
undetectable
3kmoB-5nkpA:
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.
5nof ANTHRANILATE
PHOSPHORIBOSYLTRANSF
ERASE


(Thermococcus
kodakarensis)
no annotation 4 PHE A 168
VAL A 105
VAL A 167
GLY A 172
None
0.94A 3kmoB-5nofA:
undetectable
3kmoB-5nofA:
20.78
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.
5oyj DARPIN D4B

(synthetic
construct)
no annotation 4 VAL A 106
VAL A 139
ASN A 135
GLY A 136
None
1.03A 3kmoB-5oyjA:
undetectable
3kmoB-5oyjA:
17.87
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.
5u7z ACID CERAMIDASE

(Homo sapiens)
no annotation 4 VAL B 376
VAL B 147
ASN B 286
GLY B 285
None
None
NAG  B 405 (-1.9A)
None
1.01A 3kmoB-5u7zB:
undetectable
3kmoB-5u7zB:
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.
5uj6 GLYCOSYL HYDROLASES
FAMILY 2, SUGAR
BINDING DOMAIN
PROTEIN


(Bacteroides
uniformis)
PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N)
PF11721
(Malectin)
PF16355
(DUF4982)
4 TYR A  88
VAL A 153
ASN A 155
GLY A 111
None
0.76A 3kmoB-5uj6A:
undetectable
3kmoB-5uj6A:
11.90
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.
5vk2 PRE-GLYCOPROTEIN
POLYPROTEIN GP
COMPLEX


(Lassa
mammarenavirus)
PF00798
(Arena_glycoprot)
4 PHE a 293
VAL a 298
ASN a 295
GLY a 277
NAG  a 505 ( 4.1A)
None
None
None
1.00A 3kmoB-5vk2a:
undetectable
3kmoB-5vk2a:
17.21
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.
5x2q TASTE RECEPTOR, TYPE
1, MEMBER 2A


(Oryzias latipes)
PF01094
(ANF_receptor)
4 PHE A 178
VAL A 160
ASN A 423
GLY A 424
None
None
None
NA  A 962 ( 4.6A)
0.71A 3kmoB-5x2qA:
undetectable
3kmoB-5x2qA:
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.
5x9y DNA MISMATCH REPAIR
PROTEIN MUTL


(Aquifex
aeolicus)
no annotation 4 PHE C 108
VAL C 133
ASN C  52
GLY C  53
None
0.88A 3kmoB-5x9yC:
undetectable
3kmoB-5x9yC:
22.96
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.
5y0q UPF0348 PROTEIN
B4417_3650


(Bacillus
subtilis)
no annotation 4 TYR A  72
PHE A  41
VAL A  76
GLY A  45
None
0.83A 3kmoB-5y0qA:
undetectable
3kmoB-5y0qA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6bwm TRANSIENT RECEPTOR
POTENTIAL CATION
CHANNEL SUBFAMILY V
MEMBER 2


(Oryctolagus
cuniculus)
no annotation 4 VAL A 151
VAL A 188
ASN A 184
GLY A 185
None
1.03A 3kmoB-6bwmA:
undetectable
3kmoB-6bwmA:
18.91
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.
6cyz HOMOSERINE KINASE

(Mycobacteroides
abscessus)
no annotation 4 VAL A 305
VAL A  41
ASN A 115
GLY A 116
None
1.13A 3kmoB-6cyzA:
undetectable
3kmoB-6cyzA:
21.54
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.
6f5e DD_D12_10_47

(synthetic
construct)
no annotation 4 VAL A  40
VAL A  73
ASN A  69
GLY A  70
None
1.12A 3kmoB-6f5eA:
undetectable
3kmoB-6f5eA:
18.75