SIMILAR PATTERNS OF AMINO ACIDS FOR 2AVV_A_MK1A901_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.
1aql BILE-SALT ACTIVATED
LIPASE

(Bos taurus) 		PF00135
(COesterase) 		3 ASP A 506
VAL A 484
PRO A 477
 None
 0.78A 2avvA-1aqlA:
0.0		 2avvA-1aqlA:
14.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1b1c PROTEIN
(NADPH-CYTOCHROME
P450 REDUCTASE)

(Homo sapiens) 		PF00258
(Flavodoxin_1) 		3 ASP A  58
VAL A  10
PRO A  66
 None
 0.72A 2avvA-1b1cA:
undetectable		 2avvA-1b1cA:
21.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1b9h PROTEIN
(3-AMINO-5-HYDROXYBE
NZOIC ACID SYNTHASE)

(Amycolatopsis
mediterranei) 		PF01041
(DegT_DnrJ_EryC1) 		3 ASP A 151
VAL A 119
PRO A 132
 None
 0.77A 2avvA-1b9hA:
undetectable		 2avvA-1b9hA:
14.38
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.
1c4t PROTEIN
(DIHYDROLIPOAMIDE
SUCCINYLTRANSFERASE)

(Escherichia
coli) 		PF00198
(2-oxoacid_dh) 		3 ASP A 314
VAL A 279
PRO A 275
 None
 0.78A 2avvA-1c4tA:
undetectable		 2avvA-1c4tA:
20.09
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.
1cee GTP-BINDING RHO-LIKE
PROTEIN

(Homo sapiens) 		PF00071
(Ras) 		3 ASP A 118
VAL A  84
PRO A 139
 GCP  A 181 (-2.5A)
None
None
 0.57A 2avvA-1ceeA:
0.0		 2avvA-1ceeA:
19.78
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.
1evq SERINE HYDROLASE

(Alicyclobacillus
acidocaldarius) 		PF07859
(Abhydrolase_3) 		3 ASP A 189
VAL A 257
PRO A 253
 None
 0.78A 2avvA-1evqA:
0.0		 2avvA-1evqA:
14.85
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.
1eys PHOTOSYNTHETIC
REACTION CENTER

(Thermochromatium
tepidum) 		PF02276
(CytoC_RC) 		3 ASP C  97
VAL C 268
PRO C 264
 None
 0.75A 2avvA-1eysC:
0.0		 2avvA-1eysC:
13.72
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.
1gq7 PROCLAVAMINATE
AMIDINO HYDROLASE

(Streptomyces
clavuligerus) 		PF00491
(Arginase) 		3 ASP A 219
VAL A 225
PRO A 272
 None
 0.79A 2avvA-1gq7A:
0.0		 2avvA-1gq7A:
18.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1h7y TRANSLATIONALLY
CONTROLLED TUMOR
PROTEIN

(Schizosaccharomyces
pombe) 		PF00838
(TCTP) 		3 ASP A 129
VAL A 142
PRO A 138
 None
 0.78A 2avvA-1h7yA:
0.0		 2avvA-1h7yA:
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.
1hfu LACCASE 1

(Coprinopsis
cinerea) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		3 ASP A 434
VAL A 386
PRO A 322
 None
 0.72A 2avvA-1hfuA:
undetectable		 2avvA-1hfuA:
15.58
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 ASP A  29
VAL A  32
PRO A  81
 A79  A 800 (-2.7A)
A79  A 800 ( 4.3A)
A79  A 800 ( 3.4A)
 0.56A 2avvA-1hvcA:
13.8		 2avvA-1hvcA:
46.31
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.
1ib8 CONSERVED PROTEIN
SP14.3

(Streptococcus
pneumoniae) 		PF02576
(DUF150)
PF17384
(DUF150_C) 		3 ASP A 139
VAL A 146
PRO A 149
 None
 0.78A 2avvA-1ib8A:
undetectable		 2avvA-1ib8A:
23.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1icp 12-OXOPHYTODIENOATE
REDUCTASE 1

(Solanum
lycopersicum) 		PF00724
(Oxidored_FMN) 		3 ASP A 325
VAL A  32
PRO A  35
 None
None
FMN  A 501 (-4.0A)
 0.76A 2avvA-1icpA:
undetectable		 2avvA-1icpA:
15.92
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.
1jtd BETA-LACTAMASE
INHIBITOR PROTEIN II

(Streptomyces
exfoliatus) 		PF13540
(RCC1_2) 		3 ASP B  67
VAL B  44
PRO B  59
 None
 0.80A 2avvA-1jtdB:
undetectable		 2avvA-1jtdB:
15.30
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.
1jtd BETA-LACTAMASE
INHIBITOR PROTEIN II

(Streptomyces
exfoliatus) 		PF13540
(RCC1_2) 		3 ASP B 145
VAL B 123
PRO B 137
 None
 0.72A 2avvA-1jtdB:
undetectable		 2avvA-1jtdB:
15.30
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.
1jtd BETA-LACTAMASE
INHIBITOR PROTEIN II

(Streptomyces
exfoliatus) 		PF13540
(RCC1_2) 		3 ASP B 187
VAL B 201
PRO B 215
 CA  B 502 (-2.3A)
None
None
 0.80A 2avvA-1jtdB:
undetectable		 2avvA-1jtdB:
15.30
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.
1kol FORMALDEHYDE
DEHYDROGENASE

(Pseudomonas
putida) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		3 ASP A 169
VAL A  91
PRO A 142
 ZN  A1001 ( 2.5A)
None
None
 0.65A 2avvA-1kolA:
undetectable		 2avvA-1kolA:
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.
1mpo MALTOPORIN

(Escherichia
coli) 		PF02264
(LamB) 		3 ASP A  73
VAL A  68
PRO A  79
 None
 0.80A 2avvA-1mpoA:
undetectable		 2avvA-1mpoA:
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.
1nne DNA MISMATCH REPAIR
PROTEIN MUTS

(Thermus
aquaticus) 		PF00488
(MutS_V)
PF01624
(MutS_I)
PF05188
(MutS_II)
PF05190
(MutS_IV)
PF05192
(MutS_III) 		3 ASP A 472
VAL A 452
PRO A 436
 None
 0.80A 2avvA-1nneA:
undetectable		 2avvA-1nneA:
8.95
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.
1o8v FATTY ACID BINDING
PROTEIN HOMOLOG

(Echinococcus
granulosus) 		PF00061
(Lipocalin) 		3 ASP A  17
VAL A  25
PRO A  76
 None
None
PLM  A1136 (-4.6A)
 0.78A 2avvA-1o8vA:
undetectable		 2avvA-1o8vA:
20.42
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.
1ozh ACETOLACTATE
SYNTHASE, CATABOLIC

(Klebsiella
pneumoniae) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		3 ASP A 542
VAL A 473
PRO A 498
 None
 0.76A 2avvA-1ozhA:
undetectable		 2avvA-1ozhA:
10.89
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.
1q2l PROTEASE III

(Escherichia
coli) 		PF00675
(Peptidase_M16)
PF05193
(Peptidase_M16_C)
PF16187
(Peptidase_M16_M) 		3 ASP A 736
VAL A 739
PRO A 764
 None
 0.77A 2avvA-1q2lA:
undetectable		 2avvA-1q2lA:
6.85
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.
1qaf PROTEIN (COPPER
AMINE OXIDASE)

(Escherichia
coli) 		PF01179
(Cu_amine_oxid)
PF02727
(Cu_amine_oxidN2)
PF02728
(Cu_amine_oxidN3)
PF07833
(Cu_amine_oxidN1) 		3 ASP A 329
VAL A 356
PRO A 710
 None
 0.62A 2avvA-1qafA:
undetectable		 2avvA-1qafA:
10.07
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.
1qlb FUMARATE REDUCTASE
FLAVOPROTEIN SUBUNIT

(Wolinella
succinogenes) 		PF00890
(FAD_binding_2)
PF02910
(Succ_DH_flav_C) 		3 ASP A 329
VAL A 364
PRO A 258
 None
 0.76A 2avvA-1qlbA:
undetectable		 2avvA-1qlbA:
10.10
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.
1r6m RIBONUCLEASE PH

(Pseudomonas
aeruginosa) 		PF01138
(RNase_PH)
PF03725
(RNase_PH_C) 		3 ASP A 187
VAL A 173
PRO A   4
 None
 0.76A 2avvA-1r6mA:
undetectable		 2avvA-1r6mA:
17.55
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.
1rdk MANNOSE-BINDING
PROTEIN-C

(Rattus rattus) 		PF00059
(Lectin_C) 		3 ASP 1 158
VAL 1 221
PRO 1 143
 None
 0.71A 2avvA-1rdk1:
undetectable		 2avvA-1rdk1:
21.85
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.
1sh2 RNA POLYMERASE

(Norwalk virus) 		PF00680
(RdRP_1) 		3 ASP A 278
VAL A 160
PRO A 122
 None
 0.77A 2avvA-1sh2A:
undetectable		 2avvA-1sh2A:
15.73
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.
1sjj ACTININ

(Gallus gallus) 		PF00307
(CH)
PF00435
(Spectrin)
PF08726
(EFhand_Ca_insen) 		3 ASP A 224
VAL A 229
PRO A 202
 None
 0.79A 2avvA-1sjjA:
undetectable		 2avvA-1sjjA:
8.46
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.
1v2d GLUTAMINE
AMINOTRANSFERASE

(Thermus
thermophilus) 		PF00155
(Aminotran_1_2) 		3 ASP A 195
VAL A 168
PRO A 304
 None
 0.68A 2avvA-1v2dA:
undetectable		 2avvA-1v2dA:
14.21
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.
1vkw PUTATIVE
NITROREDUCTASE

(Thermotoga
maritima) 		PF14512
(TM1586_NiRdase) 		3 ASP A  42
VAL A  97
PRO A  93
 None
 0.73A 2avvA-1vkwA:
undetectable		 2avvA-1vkwA:
20.53
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.
1wdu TRAS1 ORF2P

(Bombyx mori) 		PF14529
(Exo_endo_phos_2) 		3 ASP A  96
VAL A 111
PRO A 101
 None
 0.77A 2avvA-1wduA:
undetectable		 2avvA-1wduA:
18.26
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.
1wdu TRAS1 ORF2P

(Bombyx mori) 		PF14529
(Exo_endo_phos_2) 		3 ASP A 198
VAL A 210
PRO A 129
 None
 0.77A 2avvA-1wduA:
undetectable		 2avvA-1wduA:
18.26
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.
1whm CYLINDROMATOSIS
TUMOR SUPPRESSOR
CYLD

(Homo sapiens) 		no annotation 3 ASP A  48
VAL A  45
PRO A   8
 None
 0.78A 2avvA-1whmA:
undetectable		 2avvA-1whmA:
22.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1wlp NEUTROPHIL CYTOSOL
FACTOR 1

(Homo sapiens) 		PF00018
(SH3_1) 		3 ASP B 243
VAL B 265
PRO B 224
 None
 0.79A 2avvA-1wlpB:
undetectable		 2avvA-1wlpB:
22.66
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.
1woy METHIONYL-TRNA
SYNTHETASE

(Thermus
thermophilus) 		PF00133
(tRNA-synt_1)
PF09334
(tRNA-synt_1g) 		3 ASP A 333
VAL A 336
PRO A 308
 None
 0.80A 2avvA-1woyA:
undetectable		 2avvA-1woyA:
9.78
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.
1xqa GLYOXALASE/BLEOMYCIN
RESISTANCE PROTEIN

(Bacillus cereus) 		PF00903
(Glyoxalase) 		3 ASP A  83
VAL A  87
PRO A  90
 P6G  A 502 (-3.2A)
None
None
 0.70A 2avvA-1xqaA:
undetectable		 2avvA-1xqaA:
20.97
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.
1z48 PROBABLE
NADH-DEPENDENT
FLAVIN
OXIDOREDUCTASE YQJM

(Bacillus
subtilis) 		PF00724
(Oxidored_FMN) 		3 ASP A 302
VAL A  21
PRO A  24
 None
None
FMN  A1500 (-4.1A)
 0.73A 2avvA-1z48A:
undetectable		 2avvA-1z48A:
14.37
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.
1zv9 CELLULOSOMAL
SCAFFOLDIN ADAPTOR
PROTEIN B

(Acetivibrio
cellulolyticus) 		PF00963
(Cohesin) 		3 ASP A 151
VAL A 144
PRO A 137
 None
 0.49A 2avvA-1zv9A:
undetectable		 2avvA-1zv9A:
24.24
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.
1zvu TOPOISOMERASE IV
SUBUNIT A

(Escherichia
coli) 		PF00521
(DNA_topoisoIV)
PF03989
(DNA_gyraseA_C) 		3 ASP A 204
VAL A 210
PRO A 213
 None
 0.74A 2avvA-1zvuA:
undetectable		 2avvA-1zvuA:
10.42
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.
2aeg HYPOTHETICAL PROTEIN
AGR_PAT_140

(Agrobacterium
fabrum) 		PF02586
(SRAP) 		3 ASP A 185
VAL A 190
PRO A 128
 None
 0.73A 2avvA-2aegA:
undetectable		 2avvA-2aegA:
17.23
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.
2ams HIGH POTENTIAL
IRON-SULFUR PROTEIN

(Allochromatium
vinosum) 		PF01355
(HIPIP) 		3 ASP A  10
VAL A   7
PRO A  65
 None
SO4  A  85 (-3.6A)
None
 0.53A 2avvA-2amsA:
undetectable		 2avvA-2amsA:
18.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2cu1 MITOGEN-ACTIVATED
PROTEIN KINASE
KINASE KINASE 2

(Homo sapiens) 		PF00564
(PB1) 		3 ASP A  63
VAL A  68
PRO A  27
 None
 0.76A 2avvA-2cu1A:
undetectable		 2avvA-2cu1A:
19.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2db3 ATP-DEPENDENT RNA
HELICASE VASA

(Drosophila
melanogaster) 		PF00270
(DEAD)
PF00271
(Helicase_C) 		3 ASP A 254
VAL A 260
PRO A 268
 None
 0.50A 2avvA-2db3A:
undetectable		 2avvA-2db3A:
14.69
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.
2dgu HETEROGENEOUS
NUCLEAR
RIBONUCLEOPROTEIN Q

(Homo sapiens) 		PF00076
(RRM_1) 		3 ASP A 379
VAL A 339
PRO A 409
 None
 0.60A 2avvA-2dguA:
undetectable		 2avvA-2dguA:
18.26
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.
2dk2 HETEROGENEOUS
NUCLEAR
RIBONUCLEOPROTEIN R

(Homo sapiens) 		PF00076
(RRM_1) 		3 ASP A  58
VAL A  17
PRO A  86
 None
 0.74A 2avvA-2dk2A:
undetectable		 2avvA-2dk2A:
24.30
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.
2dph FORMALDEHYDE
DISMUTASE

(Pseudomonas
putida) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		3 ASP A 169
VAL A  90
PRO A 142
 ZN  A1002 ( 2.7A)
None
None
 0.74A 2avvA-2dphA:
undetectable		 2avvA-2dphA:
13.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2e1m L-GLUTAMATE OXIDASE

(Streptomyces
sp. X-119-6) 		PF01593
(Amino_oxidase) 		3 ASP A 250
VAL A 255
PRO A 258
 None
 0.68A 2avvA-2e1mA:
undetectable		 2avvA-2e1mA:
14.08
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.
2e6m WERNER SYNDROME
ATP-DEPENDENT
HELICASE HOMOLOG

(Mus musculus) 		PF01612
(DNA_pol_A_exo1) 		3 ASP A 137
VAL A 147
PRO A 115
 None
 0.68A 2avvA-2e6mA:
undetectable		 2avvA-2e6mA:
17.54
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.
2egz 3-DEHYDROQUINATE
DEHYDRATASE

(Aquifex
aeolicus) 		PF01487
(DHquinase_I) 		3 ASP A   8
VAL A   5
PRO A 205
 None
 0.80A 2avvA-2egzA:
undetectable		 2avvA-2egzA:
22.11
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2fmb EQUINE INFECTIOUS
ANEMIA VIRUS
PROTEASE

(Equine
infectious
anemia virus) 		PF00077
(RVP) 		3 ASP A  29
VAL A  32
PRO A  86
 LP1  A 201 (-3.6A)
None
LP1  A 201 (-3.9A)
 0.56A 2avvA-2fmbA:
15.3		 2avvA-2fmbA:
33.96
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.
2g39 ACETYL-COA HYDROLASE

(Pseudomonas
aeruginosa) 		PF02550
(AcetylCoA_hydro)
PF13336
(AcetylCoA_hyd_C) 		3 ASP A 126
VAL A 160
PRO A 207
 None
 0.70A 2avvA-2g39A:
undetectable		 2avvA-2g39A:
12.87
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.
2gpr GLUCOSE-PERMEASE IIA
COMPONENT

(Mycoplasma
capricolum) 		PF00358
(PTS_EIIA_1) 		3 ASP A 103
VAL A 106
PRO A  55
 None
 0.75A 2avvA-2gprA:
undetectable		 2avvA-2gprA:
25.31
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.
2hg4 6-DEOXYERYTHRONOLIDE
B SYNTHASE

(Saccharopolyspora
erythraea) 		PF00109
(ketoacyl-synt)
PF00698
(Acyl_transf_1)
PF02801
(Ketoacyl-synt_C)
PF08990
(Docking)
PF16197
(KAsynt_C_assoc) 		3 ASP A 114
VAL A 169
PRO A 162
 None
 0.69A 2avvA-2hg4A:
undetectable		 2avvA-2hg4A:
8.15
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.
2ime 2-HYDROXYCHROMENE-2-
CARBOXYLATE
ISOMERASE

(Pseudomonas
putida) 		PF01323
(DSBA) 		3 ASP A   8
VAL A 109
PRO A 126
 None
 0.74A 2avvA-2imeA:
undetectable		 2avvA-2imeA:
16.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2nya PERIPLASMIC NITRATE
REDUCTASE

(Escherichia
coli) 		PF00384
(Molybdopterin)
PF01568
(Molydop_binding)
PF04879
(Molybdop_Fe4S4) 		3 ASP A 726
VAL A 709
PRO A 706
 None
 0.73A 2avvA-2nyaA:
1.7		 2avvA-2nyaA:
8.70
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.
2oo3 PROTEIN INVOLVED IN
CATABOLISM OF
EXTERNAL DNA

(Legionella
pneumophila) 		PF04378
(RsmJ) 		3 ASP A 113
VAL A 138
PRO A 132
 None
 0.53A 2avvA-2oo3A:
undetectable		 2avvA-2oo3A:
15.90
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.
2p50 N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE

(Escherichia
coli) 		PF01979
(Amidohydro_1) 		3 ASP A  25
VAL A  22
PRO A  38
 None
 0.75A 2avvA-2p50A:
undetectable		 2avvA-2p50A:
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.
2pes URICASE

(Aspergillus
flavus) 		PF01014
(Uricase) 		3 ASP A 141
VAL A 130
PRO A  75
 None
 0.78A 2avvA-2pesA:
undetectable		 2avvA-2pesA:
20.94
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.
2pg6 CYTOCHROME P450 2A6

(Homo sapiens) 		PF00067
(p450) 		3 ASP A 427
VAL A 398
PRO A 393
 None
 0.80A 2avvA-2pg6A:
undetectable		 2avvA-2pg6A:
14.52
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.
2q3o 12-OXOPHYTODIENOATE
REDUCTASE 3

(Arabidopsis
thaliana) 		PF00724
(Oxidored_FMN) 		3 ASP A 338
VAL A  28
PRO A  31
 None
None
FMN  A7401 (-4.3A)
 0.73A 2avvA-2q3oA:
undetectable		 2avvA-2q3oA:
12.70
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.
2q3r 12-OXOPHYTODIENOATE
REDUCTASE 1

(Arabidopsis
thaliana) 		PF00724
(Oxidored_FMN) 		3 ASP A 321
VAL A  28
PRO A  31
 None
None
FMN  A 373 (-4.2A)
 0.68A 2avvA-2q3rA:
undetectable		 2avvA-2q3rA:
16.76
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.
2q7x UPF0052 PROTEIN
SP_1565

(Streptococcus
pneumoniae) 		PF01933
(UPF0052) 		3 ASP A 282
VAL A 240
PRO A 250
 None
 0.75A 2avvA-2q7xA:
undetectable		 2avvA-2q7xA:
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.
2qgh DIAMINOPIMELATE
DECARBOXYLASE

(Helicobacter
pylori) 		PF00278
(Orn_DAP_Arg_deC)
PF02784
(Orn_Arg_deC_N) 		3 ASP A 290
VAL A 287
PRO A 342
 None
 0.74A 2avvA-2qghA:
undetectable		 2avvA-2qghA:
14.48
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.
2qjt NICOTINAMIDE-NUCLEOT
IDE
ADENYLYLTRANSFERASE

(Francisella
tularensis) 		no annotation 3 ASP B 173
VAL B 176
PRO B  48
 None
 0.71A 2avvA-2qjtB:
undetectable		 2avvA-2qjtB:
14.78
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.
2qyg RIBULOSE
BISPHOSPHATE
CARBOXYLASE-LIKE
PROTEIN 2

(Rhodopseudomonas
palustris) 		PF00016
(RuBisCO_large)
PF02788
(RuBisCO_large_N) 		3 ASP A 376
VAL A 318
PRO A 283
 None
 0.77A 2avvA-2qygA:
undetectable		 2avvA-2qygA:
14.14
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.
2r51 VACUOLAR PROTEIN
SORTING-ASSOCIATED
PROTEIN 26B

(Mus musculus) 		PF03643
(Vps26) 		3 ASP A 146
VAL A 149
PRO A 115
 None
 0.70A 2avvA-2r51A:
undetectable		 2avvA-2r51A:
15.09
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.
2rqa ATP-DEPENDENT RNA
HELICASE DHX58

(Homo sapiens) 		PF11648
(RIG-I_C-RD) 		3 ASP A 568
VAL A 659
PRO A 656
 None
 0.76A 2avvA-2rqaA:
undetectable		 2avvA-2rqaA:
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.
2x0s PYRUVATE PHOSPHATE
DIKINASE

(Trypanosoma
brucei) 		PF00391
(PEP-utilizers)
PF01326
(PPDK_N)
PF02896
(PEP-utilizers_C) 		3 ASP A 355
VAL A 247
PRO A  43
 None
 0.77A 2avvA-2x0sA:
undetectable		 2avvA-2x0sA:
8.31
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.
2xci 3-DEOXY-D-MANNO-2-OC
TULOSONIC ACID
TRANSFERASE

(Aquifex
aeolicus) 		PF04413
(Glycos_transf_N) 		3 ASP A 226
VAL A 188
PRO A 211
 None
 0.69A 2avvA-2xciA:
undetectable		 2avvA-2xciA:
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.
2xly CLOQ

(Streptomyces
roseochromogenus) 		PF11468
(PTase_Orf2) 		3 ASP A 182
VAL A 203
PRO A 197
 None
 0.80A 2avvA-2xlyA:
undetectable		 2avvA-2xlyA:
17.00
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.
2xrc HUMAN COMPLEMENT
FACTOR I

(Homo sapiens) 		PF00057
(Ldl_recept_a)
PF00089
(Trypsin)
PF00530
(SRCR) 		3 ASP A 447
VAL A 471
PRO A 538
 None
 0.65A 2avvA-2xrcA:
undetectable		 2avvA-2xrcA:
11.68
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.
3bj1 HEMOGLOBIN ALPHA
HEMOGLOBIN BETA

(Perca
flavescens) 		PF00042
(Globin) 		3 ASP B  19
VAL B 113
PRO A 120
 None
 0.80A 2avvA-3bj1B:
undetectable		 2avvA-3bj1B:
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.
3d6k PUTATIVE
AMINOTRANSFERASE

(Corynebacterium
diphtheriae) 		PF12897
(Aminotran_MocR) 		3 ASP A 163
VAL A 135
PRO A 384
 None
 0.77A 2avvA-3d6kA:
undetectable		 2avvA-3d6kA:
12.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3d7r ESTERASE

(Staphylococcus
aureus) 		PF07859
(Abhydrolase_3) 		3 ASP A 299
VAL A 302
PRO A 237
 None
 0.79A 2avvA-3d7rA:
undetectable		 2avvA-3d7rA:
14.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3dls PAS
DOMAIN-CONTAINING
SERINE/THREONINE-PRO
TEIN KINASE

(Homo sapiens) 		PF00069
(Pkinase) 		3 ASP A1101
VAL A1220
PRO A1217
 None
 0.75A 2avvA-3dlsA:
undetectable		 2avvA-3dlsA:
13.08
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.
3e6m MARR FAMILY
TRANSCRIPTIONAL
REGULATOR

(Ruegeria
pomeroyi) 		PF01047
(MarR) 		3 ASP A 127
VAL A 133
PRO A 138
 None
 0.60A 2avvA-3e6mA:
undetectable		 2avvA-3e6mA:
20.50
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.
3ed4 ARYLSULFATASE

(Escherichia
coli) 		PF00884
(Sulfatase) 		3 ASP A 293
VAL A 241
PRO A 322
 None
 0.69A 2avvA-3ed4A:
undetectable		 2avvA-3ed4A:
11.54
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.
3edy TRIPEPTIDYL-PEPTIDAS
E 1

(Homo sapiens) 		PF09286
(Pro-kuma_activ) 		3 ASP A 543
VAL A 426
PRO A 419
 CA  A   1 (-3.3A)
None
EDO  A 701 (-4.8A)
 0.78A 2avvA-3edyA:
undetectable		 2avvA-3edyA:
11.97
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.
3es5 PUTATIVE CAPSID
PROTEIN

(Penicillium
stoloniferum
virus F) 		no annotation 3 ASP A 237
VAL A 245
PRO A 248
 None
 0.67A 2avvA-3es5A:
undetectable		 2avvA-3es5A:
13.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ge6 NITROREDUCTASE

(Exiguobacterium
sibiricum) 		PF00881
(Nitroreductase) 		3 ASP A  58
VAL A  77
PRO A  68
 None
 0.79A 2avvA-3ge6A:
undetectable		 2avvA-3ge6A:
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.
3ghy KETOPANTOATE
REDUCTASE PROTEIN

(Ralstonia
solanacearum) 		PF02558
(ApbA)
PF08546
(ApbA_C) 		3 ASP A  70
VAL A  98
PRO A 135
 None
 0.50A 2avvA-3ghyA:
undetectable		 2avvA-3ghyA:
13.43
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.
3gl1 HEAT SHOCK PROTEIN
SSB1

(Saccharomyces
cerevisiae) 		PF00012
(HSP70) 		3 ASP A 335
VAL A 338
PRO A 178
 None
 0.80A 2avvA-3gl1A:
undetectable		 2avvA-3gl1A:
14.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gr8 NADPH DEHYDROGENASE

(Geobacillus
kaustophilus) 		PF00724
(Oxidored_FMN) 		3 ASP A 302
VAL A  21
PRO A  24
 None
None
FMN  A 341 (-4.3A)
 0.73A 2avvA-3gr8A:
undetectable		 2avvA-3gr8A:
13.95
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.
3h7k AGMATINE DEIMINASE

(Arabidopsis
thaliana) 		PF04371
(PAD_porph) 		3 ASP A 226
VAL A 168
PRO A  16
 AGT  A 366 ( 2.2A)
None
None
 0.74A 2avvA-3h7kA:
undetectable		 2avvA-3h7kA:
16.38
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.
3hgo 12-OXOPHYTODIENOATE
REDUCTASE 3

(Solanum
lycopersicum) 		PF00724
(Oxidored_FMN) 		3 ASP A 337
VAL A  28
PRO A  31
 None
None
FMN  A 401 (-3.9A)
 0.68A 2avvA-3hgoA:
undetectable		 2avvA-3hgoA:
14.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3hkz DNA-DIRECTED RNA
POLYMERASE SUBUNIT
A'

(Sulfolobus
solfataricus) 		PF00623
(RNA_pol_Rpb1_2)
PF04983
(RNA_pol_Rpb1_3)
PF04997
(RNA_pol_Rpb1_1)
PF04998
(RNA_pol_Rpb1_5)
PF05000
(RNA_pol_Rpb1_4) 		3 ASP A 278
VAL A 273
PRO A 213
 None
 0.73A 2avvA-3hkzA:
2.8		 2avvA-3hkzA:
9.03
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.
3hn5 PUTATIVE EXPORTED
PROTEIN BF0290

(Bacteroides
fragilis) 		PF12866
(DUF3823) 		3 ASP A 116
VAL A 119
PRO A  96
 None
 0.76A 2avvA-3hn5A:
undetectable		 2avvA-3hn5A:
15.46
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.
3ian CHITINASE

(Lactococcus
lactis) 		PF00704
(Glyco_hydro_18) 		3 ASP A 155
VAL A  82
PRO A  98
 NA  A   1 ( 2.9A)
None
None
 0.71A 2avvA-3ianA:
undetectable		 2avvA-3ianA:
13.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ilw DNA GYRASE SUBUNIT A

(Mycobacterium
tuberculosis) 		PF00521
(DNA_topoisoIV) 		3 ASP A 359
VAL A 223
PRO A 226
 None
 0.64A 2avvA-3ilwA:
undetectable		 2avvA-3ilwA:
11.39
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.
3k28 GLUTAMATE-1-SEMIALDE
HYDE 2,1-AMINOMUTASE
2

(Bacillus
anthracis) 		PF00202
(Aminotran_3) 		3 ASP A  51
VAL A 388
PRO A 396
 None
 0.80A 2avvA-3k28A:
undetectable		 2avvA-3k28A:
13.90
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.
3l6a EUKARYOTIC
TRANSLATION
INITIATION FACTOR 4
GAMMA 2

(Homo sapiens) 		PF02020
(W2)
PF02847
(MA3) 		3 ASP A 285
VAL A 227
PRO A 223
 None
 0.70A 2avvA-3l6aA:
undetectable		 2avvA-3l6aA:
11.76
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.
3l8q CELLULOSOMAL
SCAFFOLDIN ADAPTOR
PROTEIN B

(Acetivibrio
cellulolyticus) 		PF00963
(Cohesin) 		3 ASP A 151
VAL A 144
PRO A 137
 None
 0.64A 2avvA-3l8qA:
undetectable		 2avvA-3l8qA:
17.15
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.
3lb6 INTERLEUKIN-13
RECEPTOR SUBUNIT
ALPHA-2

(Homo sapiens) 		PF09240
(IL6Ra-bind) 		3 ASP D 318
VAL D 312
PRO D 266
 None
 0.65A 2avvA-3lb6D:
undetectable		 2avvA-3lb6D:
15.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ldo 78 KDA
GLUCOSE-REGULATED
PROTEIN

(Homo sapiens) 		PF00012
(HSP70) 		3 ASP A 357
VAL A 360
PRO A 202
 None
 0.74A 2avvA-3ldoA:
undetectable		 2avvA-3ldoA:
15.10
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.
3lpd ACIDIC EXTRACELLULAR
SUBTILISIN-LIKE
PROTEASE APRV2

(Dichelobacter
nodosus) 		PF00082
(Peptidase_S8) 		3 ASP A  79
VAL A  39
PRO A 281
 None
 0.76A 2avvA-3lpdA:
undetectable		 2avvA-3lpdA:
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.
3lun ULILYSIN

(Methanosarcina
acetivorans) 		PF05572
(Peptidase_M43) 		3 ASP A 294
VAL A 299
PRO A 109
 None
 0.65A 2avvA-3lunA:
undetectable		 2avvA-3lunA:
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.
3mtx PROTEIN MD-1

(Gallus gallus) 		PF02221
(E1_DerP2_DerF2) 		3 ASP A 151
VAL A 154
PRO A 129
 None
 0.66A 2avvA-3mtxA:
undetectable		 2avvA-3mtxA:
21.48
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 ASP A  29
VAL A  32
PRO A  81
 None
 0.41A 2avvA-3mwsA:
19.6		 2avvA-3mwsA:
78.79
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.
3na6 SUCCINYLGLUTAMATE
DESUCCINYLASE/ASPART
OACYLASE

(Ruegeria sp.
TM1040) 		PF04952
(AstE_AspA) 		3 ASP A 151
VAL A 324
PRO A 253
 None
 0.67A 2avvA-3na6A:
undetectable		 2avvA-3na6A:
20.47
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.
3npg UNCHARACTERIZED
DUF364 FAMILY
PROTEIN

(Pyrococcus
horikoshii) 		PF04016
(DUF364)
PF13938
(DUF4213) 		3 ASP A 154
VAL A 139
PRO A 125
 None
 0.78A 2avvA-3npgA:
undetectable		 2avvA-3npgA:
17.87