SIMILAR PATTERNS OF AMINO ACIDS FOR 2AVO_B_MK1B902_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.
1e5f METHIONINE
GAMMA-LYASE


(Trichomonas
vaginalis)
PF01053
(Cys_Met_Meta_PP)
5 LEU A 229
ILE A 240
ILE A  90
VAL A  81
ILE A 232
None
1.12A 2avoA-1e5fA:
undetectable
2avoA-1e5fA:
17.39
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.
1fxl PARANEOPLASTIC
ENCEPHALOMYELITIS
ANTIGEN HUD


(Homo sapiens)
PF00076
(RRM_1)
5 LEU A 186
GLY A 167
ILE A 156
VAL A 200
ILE A 198
None
1.07A 2avoA-1fxlA:
undetectable
2avoA-1fxlA:
23.42
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1hvc HIV-1 PROTEASE

(Human
immunodeficiency
virus 1)
PF00077
(RVP)
5 ARG A   8
LEU A  23
ASP A  25
ILE A  47
VAL A  82
A79  A 800 (-3.6A)
A79  A 800 ( 4.0A)
A79  A 800 (-2.8A)
A79  A 800 ( 3.4A)
A79  A 800 (-4.5A)
0.84A 2avoA-1hvcA:
14.4
2avoA-1hvcA:
46.31
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)
8 LEU A  23
ASP A  25
ILE A  47
GLY A  49
ILE A  50
PRO A  81
VAL A  82
ILE A  84
A79  A 800 ( 3.8A)
A79  A 800 (-2.7A)
A79  A 800 ( 3.2A)
A79  A 800 ( 3.7A)
A79  A 800 (-3.8A)
A79  A 800 ( 3.9A)
A79  A 800 (-4.5A)
A79  A 800 (-3.6A)
0.59A 2avoA-1hvcA:
14.4
2avoA-1hvcA:
46.31
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)
8 LEU A  23
ASP A  25
ILE A  47
GLY A  49
ILE A  50
PRO A  81
VAL A  82
ILE A  84
A79  A 800 ( 4.0A)
A79  A 800 (-2.8A)
A79  A 800 ( 3.4A)
A79  A 800 (-3.4A)
A79  A 800 ( 4.0A)
A79  A 800 ( 3.4A)
A79  A 800 (-4.5A)
A79  A 800 (-3.8A)
0.66A 2avoA-1hvcA:
14.4
2avoA-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.
1ibq ASPERGILLOPEPSIN

(Aspergillus
phoenicis)
PF00026
(Asp)
5 LEU A 156
ASP A 302
ILE A 212
GLY A  34
VAL A 154
None
None
None
ZN  A1457 (-3.6A)
None
1.05A 2avoA-1ibqA:
6.3
2avoA-1ibqA:
15.02
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.
1id8 METHYLASPARTATE
MUTASE S CHAIN


(Clostridium
tetanomorphum)
PF02310
(B12-binding)
5 LEU A  88
ILE A  37
ILE A  69
VAL A  90
ILE A  58
None
0.98A 2avoA-1id8A:
undetectable
2avoA-1id8A:
26.39
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.
1ize ASPARTIC PROTEINASE

(Aspergillus
oryzae)
PF00026
(Asp)
5 LEU A 157
ASP A 300
ILE A 212
GLY A  35
VAL A 155
None
1.01A 2avoA-1izeA:
6.5
2avoA-1izeA:
15.81
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.
1jqe HISTAMINE
N-METHYLTRANSFERASE


(Homo sapiens)
PF13489
(Methyltransf_23)
5 LEU A  71
ASP A  67
ILE A 171
ILE A  59
ILE A  70
None
1.01A 2avoA-1jqeA:
undetectable
2avoA-1jqeA:
14.63
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.
1k4y LIVER
CARBOXYLESTERASE


(Oryctolagus
cuniculus)
PF00135
(COesterase)
5 LEU A 475
GLY A 223
ILE A 139
VAL A 474
ILE A 471
None
1.10A 2avoA-1k4yA:
undetectable
2avoA-1k4yA:
12.24
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.
1lk5 D-RIBOSE-5-PHOSPHATE
ISOMERASE


(Pyrococcus
horikoshii)
PF06026
(Rib_5-P_isom_A)
5 LEU A 161
ILE A 200
GLY A 202
ILE A 141
ILE A 180
None
1.01A 2avoA-1lk5A:
undetectable
2avoA-1lk5A:
17.72
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.
1o94 TRIMETHYLAMINE
DEHYDROGENASE


(Methylophilus
methylotrophus)
PF00724
(Oxidored_FMN)
PF07992
(Pyr_redox_2)
5 LEU A 650
GLY A 668
ILE A 666
VAL A 395
ILE A 485
ADP  A1731 ( 4.6A)
None
None
ADP  A1731 (-4.7A)
None
1.02A 2avoA-1o94A:
undetectable
2avoA-1o94A:
10.28
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.
1poi GLUTACONATE COENZYME
A-TRANSFERASE


(Acidaminococcus
fermentans)
PF01144
(CoA_trans)
5 ILE B  21
GLY B  37
ILE B  36
VAL B  53
ILE B  51
None
0.98A 2avoA-1poiB:
undetectable
2avoA-1poiB:
16.41
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.
1q90 APOCYTOCHROME F

(Chlamydomonas
reinhardtii)
PF01333
(Apocytochr_F_C)
PF16639
(Apocytochr_F_N)
5 LEU A  83
ILE A 244
ILE A  76
VAL A 128
ILE A 130
None
1.05A 2avoA-1q90A:
undetectable
2avoA-1q90A:
18.73
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.
1qrp PEPSIN 3A

(Homo sapiens)
PF00026
(Asp)
5 LEU E 155
ASP E 303
ILE E 213
GLY E  34
VAL E 153
None
None
None
HH0  E 327 (-4.1A)
None
1.01A 2avoA-1qrpE:
6.7
2avoA-1qrpE:
15.95
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.
1sd5 PUTATIVE
ANTITERMINATOR


(Mycobacterium
tuberculosis)
PF00072
(Response_reg)
PF03861
(ANTAR)
5 LEU A  61
ILE A  25
ILE A 118
VAL A  16
ILE A  63
None
IOD  A 414 ( 4.4A)
None
None
None
1.01A 2avoA-1sd5A:
undetectable
2avoA-1sd5A:
18.54
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1siv SIV PROTEASE

(Simian
immunodeficiency
virus)
PF00077
(RVP)
7 ARG A   8
LEU A  23
ASP A  25
GLY A  49
ILE A  50
PRO A  81
ILE A  84
None
0.68A 2avoA-1sivA:
18.1
2avoA-1sivA:
50.98
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.
1sr8 COBALAMIN
BIOSYNTHESIS PROTEIN
(CBID)


(Archaeoglobus
fulgidus)
PF01888
(CbiD)
5 LEU A 243
ASP A 240
ILE A 260
GLY A 263
ILE A 239
None
1.12A 2avoA-1sr8A:
undetectable
2avoA-1sr8A:
15.72
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.
1u3b AMYLOID BETA A4
PRECURSOR
PROTEIN-BINDING,
FAMILY A, MEMBER 1


(Homo sapiens)
PF00595
(PDZ)
5 LEU A 101
GLY A  67
ILE A  66
VAL A  21
ILE A 103
None
1.08A 2avoA-1u3bA:
undetectable
2avoA-1u3bA:
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.
2afv COBALAMIN
BIOSYNTHESIS
PRECORRIN ISOMERASE


(Leptospira
interrogans)
PF02570
(CbiC)
5 ILE A 194
GLY A 165
ILE A 139
PRO A 160
ILE A 136
None
0.91A 2avoA-2afvA:
undetectable
2avoA-2afvA:
18.14
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.
2bty ACETYLGLUTAMATE
KINASE


(Thermotoga
maritima)
PF00696
(AA_kinase)
5 LEU A 199
ILE A 213
ILE A 225
VAL A 252
ILE A 254
None
1.04A 2avoA-2btyA:
undetectable
2avoA-2btyA:
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.
2bws XAA-PRO
AMINOPEPTIDASE P


(Escherichia
coli)
PF00557
(Peptidase_M24)
PF05195
(AMP_N)
5 LEU A 433
ILE A 403
ILE A 259
VAL A 424
ILE A 430
None
1.11A 2avoA-2bwsA:
undetectable
2avoA-2bwsA:
13.19
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.
2c1d SOXA
SOXX


(Paracoccus
denitrificans;
Paracoccus
pantotrophus)
PF00034
(Cytochrom_C)
no annotation
5 ARG A 219
GLY B  49
ILE B  52
VAL B  73
ILE B  67
None
0.95A 2avoA-2c1dA:
undetectable
2avoA-2c1dA:
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.
2cev PROTEIN (ARGINASE)

([Bacillus]
caldovelox)
PF00491
(Arginase)
5 LEU A  36
GLY A  47
ILE A   7
VAL A  32
ILE A  33
None
1.04A 2avoA-2cevA:
undetectable
2avoA-2cevA:
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.
2cev PROTEIN (ARGINASE)

([Bacillus]
caldovelox)
PF00491
(Arginase)
5 LEU A  46
ILE A 101
GLY A 104
PRO A  92
ILE A   7
None
1.10A 2avoA-2cevA:
undetectable
2avoA-2cevA:
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.
2cun PHOSPHOGLYCERATE
KINASE


(Pyrococcus
horikoshii)
PF00162
(PGK)
5 LEU A 316
ILE A 376
GLY A 357
VAL A 343
ILE A 347
None
0.81A 2avoA-2cunA:
undetectable
2avoA-2cunA:
14.73
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.
2cv6 SEED STORAGE PROTEIN

(Vigna radiata)
PF00190
(Cupin_1)
5 LEU A 296
ILE A 287
ILE A 284
VAL A 336
ILE A 294
None
1.10A 2avoA-2cv6A:
undetectable
2avoA-2cv6A:
14.46
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.
2e8y AMYX PROTEIN

(Bacillus
subtilis)
PF00128
(Alpha-amylase)
PF02922
(CBM_48)
5 LEU A  36
GLY A  88
ILE A  87
VAL A  75
ILE A  18
None
1.10A 2avoA-2e8yA:
undetectable
2avoA-2e8yA:
8.48
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.
2f2l PEPTIDOGLYCAN-RECOGN
ITION PROTEIN-LC
ISOFORM LCA


(Drosophila
melanogaster)
PF01510
(Amidase_2)
5 LEU A 403
ASP A 407
ILE A 370
GLY A 438
ILE A 416
None
1.09A 2avoA-2f2lA:
undetectable
2avoA-2f2lA:
18.56
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)
6 ARG A   8
LEU A  23
ASP A  25
ILE A  53
PRO A  86
ILE A  89
LP1  A 201 (-3.5A)
None
LP1  A 201 (-2.3A)
LP1  A 201 (-4.6A)
LP1  A 201 (-3.9A)
LP1  A 201 (-4.2A)
0.76A 2avoA-2fmbA:
14.8
2avoA-2fmbA:
33.02
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)
7 LEU A  23
ASP A  25
ILE A  53
GLY A  55
PRO A  86
VAL A  87
ILE A  89
None
LP1  A 201 (-2.3A)
LP1  A 201 (-4.6A)
LP1  A 201 (-3.4A)
LP1  A 201 (-3.9A)
LP1  A 201 ( 4.9A)
LP1  A 201 (-4.2A)
0.73A 2avoA-2fmbA:
14.8
2avoA-2fmbA:
33.02
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.
2gwr DNA-BINDING RESPONSE
REGULATOR MTRA


(Mycobacterium
tuberculosis)
PF00072
(Response_reg)
PF00486
(Trans_reg_C)
5 ARG A 167
LEU A 131
ILE A 152
VAL A 140
ILE A 138
GOL  A2648 (-4.0A)
None
None
None
None
1.08A 2avoA-2gwrA:
undetectable
2avoA-2gwrA:
20.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2jir PERIPLASMIC NITRATE
REDUCTASE


(Desulfovibrio
desulfuricans)
PF00384
(Molybdopterin)
PF01568
(Molydop_binding)
PF04879
(Molybdop_Fe4S4)
5 LEU A 613
ILE A 655
ILE A 662
VAL A 687
ILE A 685
None
0.94A 2avoA-2jirA:
undetectable
2avoA-2jirA:
10.28
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.
2lnv GENERAL SECRETION
PATHWAY PROTEIN C


(Dickeya
dadantii)
PF11356
(T2SSC)
5 LEU A 145
ILE A 110
PRO A 129
VAL A 128
ILE A 135
None
0.97A 2avoA-2lnvA:
undetectable
2avoA-2lnvA:
17.43
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.
2nr7 SECRETION ACTIVATOR
PROTEIN, PUTATIVE


(Porphyromonas
gingivalis)
PF05838
(Glyco_hydro_108)
PF09374
(PG_binding_3)
5 LEU A 134
GLY A 102
ILE A 103
VAL A  87
ILE A 138
None
0.81A 2avoA-2nr7A:
undetectable
2avoA-2nr7A:
22.03
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.
2pcr INOSITOL-1-MONOPHOSP
HATASE


(Aquifex
aeolicus)
PF00459
(Inositol_P)
5 ARG A  82
ILE A 221
ILE A 215
PRO A 113
VAL A 108
None
1.11A 2avoA-2pcrA:
undetectable
2avoA-2pcrA:
19.47
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.
2q7x UPF0052 PROTEIN
SP_1565


(Streptococcus
pneumoniae)
PF01933
(UPF0052)
5 ARG A 300
GLY A 192
PRO A  16
VAL A  17
ILE A  18
None
1.11A 2avoA-2q7xA:
undetectable
2avoA-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.
2qde MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN


(Aromatoleum
aromaticum)
PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C)
5 LEU A 369
ILE A  31
GLY A  33
VAL A 374
ILE A 345
None
1.02A 2avoA-2qdeA:
undetectable
2avoA-2qdeA:
13.39
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2rkf PROTEASE RETROPEPSIN

(Human
immunodeficiency
virus 1)
PF00077
(RVP)
7 ARG A   8
LEU A  23
ASP A  25
GLY A  49
ILE A  50
PRO A  81
ILE A  84
AB1  A 501 ( 4.7A)
None
AB1  A 501 (-2.4A)
AB1  A 501 (-3.5A)
AB1  A 501 (-3.8A)
AB1  A 501 (-4.2A)
AB1  A 501 ( 4.2A)
0.70A 2avoA-2rkfA:
20.7
2avoA-2rkfA:
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.
2w20 SIALIDASE A

(Streptococcus
pneumoniae)
PF13088
(BNR_2)
5 LEU A 536
GLY A 613
ILE A 585
VAL A 558
ILE A 554
None
0.94A 2avoA-2w20A:
undetectable
2avoA-2w20A:
12.15
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.
2wed PENICILLOPEPSIN

(Penicillium
janthinellum)
PF00026
(Asp)
5 LEU A 157
ASP A 300
ILE A 211
GLY A  35
VAL A 155
None
None
None
PP6  A 327 (-4.0A)
None
0.99A 2avoA-2wedA:
7.4
2avoA-2wedA:
14.84
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.
2wfd LEUCYL-TRNA
SYNTHETASE,
CYTOPLASMIC


(Homo sapiens)
PF00133
(tRNA-synt_1)
5 ILE A 287
GLY A 315
ILE A 314
VAL A 307
ILE A 357
None
1.00A 2avoA-2wfdA:
undetectable
2avoA-2wfdA:
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.
2y23 MYOMESIN

(Homo sapiens)
PF07679
(I-set)
5 ASP A1401
GLY A1409
ILE A1410
VAL A1428
ILE A1389
None
0.75A 2avoA-2y23A:
undetectable
2avoA-2y23A:
17.79
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.
2zj4 GLUCOSAMINE--FRUCTOS
E-6-PHOSPHATE
AMINOTRANSFERASE
[ISOMERIZING] 1


(Homo sapiens)
PF01380
(SIS)
5 ILE A 634
ILE A 592
PRO A 615
VAL A 588
ILE A 589
None
1.07A 2avoA-2zj4A:
undetectable
2avoA-2zj4A:
14.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3cdk SUCCINYL-COA:3-KETOA
CID-COENZYME A
TRANSFERASE SUBUNIT
B


(Bacillus
subtilis)
PF01144
(CoA_trans)
5 LEU B  44
ILE B  67
GLY B  70
ILE B  26
ILE B  53
None
1.06A 2avoA-3cdkB:
undetectable
2avoA-3cdkB:
19.63
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.
3clj PROTEIN NRD1

(Saccharomyces
cerevisiae)
PF04818
(CTD_bind)
5 LEU A 108
GLY A  73
ILE A  72
VAL A 104
ILE A 105
None
0.97A 2avoA-3cljA:
undetectable
2avoA-3cljA:
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.
3euj CHROMOSOME PARTITION
PROTEIN MUKB, LINKER


([Haemophilus]
ducreyi)
PF04310
(MukB)
PF13558
(SbcCD_C)
5 LEU A1290
GLY A1396
ILE A1399
VAL A1301
ILE A1293
None
1.06A 2avoA-3eujA:
undetectable
2avoA-3eujA:
12.76
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.
3i0m DNA REPAIR AND
TELOMERE MAINTENANCE
PROTEIN NBS1


(Schizosaccharomyces
pombe)
PF00498
(FHA)
5 ILE A  52
GLY A 137
ILE A 138
VAL A 191
ILE A  17
None
0.85A 2avoA-3i0mA:
undetectable
2avoA-3i0mA:
15.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3lun ULILYSIN

(Methanosarcina
acetivorans)
PF05572
(Peptidase_M43)
5 LEU A 171
GLY A 211
ILE A  93
VAL A  69
ILE A 173
None
1.02A 2avoA-3lunA:
undetectable
2avoA-3lunA:
17.00
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)
9 ARG A   8
LEU A  23
ASP A  25
ILE A  47
GLY A  49
ILE A  50
PRO A  81
VAL A  82
ILE A  84
None
0.68A 2avoA-3mwsA:
19.4
2avoA-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.
3nvs 3-PHOSPHOSHIKIMATE
1-CARBOXYVINYLTRANSF
ERASE


(Vibrio cholerae)
PF00275
(EPSP_synthase)
5 ILE A 271
GLY A 273
ILE A 312
VAL A 295
ILE A 266
None
1.04A 2avoA-3nvsA:
undetectable
2avoA-3nvsA:
12.22
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3t3c HIV-1 PROTEASE

(Human
immunodeficiency
virus 1)
PF00077
(RVP)
5 ARG A   8
ASP A  25
ILE A  47
GLY A  49
ILE A  50
SO4  A 101 (-3.8A)
017  A 201 (-2.6A)
None
017  A 201 (-4.0A)
017  A 201 (-3.3A)
0.76A 2avoA-3t3cA:
18.7
2avoA-3t3cA:
73.74
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3t3c HIV-1 PROTEASE

(Human
immunodeficiency
virus 1)
PF00077
(RVP)
5 LEU A  23
ASP A  25
ILE A  47
GLY A  49
ILE A  50
SO4  A 101 (-4.2A)
017  A 201 (-2.6A)
None
017  A 201 (-4.0A)
017  A 201 (-3.3A)
0.48A 2avoA-3t3cA:
18.7
2avoA-3t3cA:
73.74
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3t3c HIV-1 PROTEASE

(Human
immunodeficiency
virus 1)
PF00077
(RVP)
5 LEU A  23
ASP A  25
ILE A  47
GLY A  49
PRO A  81
SO4  A 101 (-4.2A)
017  A 201 (-2.6A)
None
017  A 201 (-4.0A)
None
0.76A 2avoA-3t3cA:
18.7
2avoA-3t3cA:
73.74
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ttp HIV-1 PROTEASE

(Human
immunodeficiency
virus 1)
PF00077
(RVP)
7 ARG A   8
LEU A  23
ASP A  25
GLY A  49
ILE A  50
PRO A  81
ILE A  84
017  A 201 ( 4.8A)
None
017  A 201 (-2.6A)
017  A 201 (-3.0A)
017  A 201 (-3.3A)
017  A 201 (-4.1A)
017  A 201 (-4.7A)
0.61A 2avoA-3ttpA:
19.2
2avoA-3ttpA:
75.76
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3u7s POL POLYPROTEIN

(Human
immunodeficiency
virus 1)
PF00077
(RVP)
7 ARG A   8
LEU A  23
ASP A  25
ILE A  47
GLY A  49
ILE A  50
PRO A  81
None
None
017  A 202 ( 2.5A)
017  A 202 (-3.6A)
017  A 202 (-2.9A)
017  A 201 ( 3.5A)
017  A 202 (-4.0A)
0.74A 2avoA-3u7sA:
19.8
2avoA-3u7sA:
75.76
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.
3vzq ACETOACETYL-COA
REDUCTASE


(Cupriavidus
necator)
PF00106
(adh_short)
5 LEU A 199
GLY A 184
ILE A 186
VAL A 203
ILE A 202
None
1.10A 2avoA-3vzqA:
undetectable
2avoA-3vzqA:
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.
4a9a RIBOSOME-INTERACTING
GTPASE 1


(Saccharomyces
cerevisiae)
PF01926
(MMR_HSR1)
PF02824
(TGS)
PF16897
(MMR_HSR1_Xtn)
5 LEU A 145
ILE A 122
GLY A  72
ILE A 149
VAL A  68
None
0.95A 2avoA-4a9aA:
undetectable
2avoA-4a9aA:
15.43
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.
4avo BETA-1,4-EXOCELLULAS
E


(Thermobifida
fusca)
PF01341
(Glyco_hydro_6)
5 LEU A 178
GLY A 313
ILE A 315
VAL A 217
ILE A 219
None
0.95A 2avoA-4avoA:
undetectable
2avoA-4avoA:
14.00
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.
4azw WBDD

(Escherichia
coli)
PF00069
(Pkinase)
PF13847
(Methyltransf_31)
5 LEU A 117
GLY A 127
ILE A 126
VAL A 113
ILE A 114
None
0.97A 2avoA-4azwA:
undetectable
2avoA-4azwA:
13.12
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.
4clc UPF0303 PROTEIN
YBR137W


(Saccharomyces
cerevisiae)
PF03928
(Haem_degrading)
5 LEU E 151
ILE E  63
GLY E  43
VAL E  59
ILE E 148
None
1.09A 2avoA-4clcE:
undetectable
2avoA-4clcE:
18.99
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.
4ex9 ALNA

(Streptomyces
sp. CM020)
PF04227
(Indigoidine_A)
5 LEU A   9
ILE A  87
GLY A 108
ILE A 110
VAL A  68
None
0.93A 2avoA-4ex9A:
undetectable
2avoA-4ex9A:
15.82
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.
4fe9 OUTER MEMBRANE
PROTEIN SUSF


(Bacteroides
thetaiotaomicron)
PF16411
(SusF_SusE)
PF17142
(DUF5115)
5 LEU A 387
ILE A 453
GLY A 482
VAL A 427
ILE A 429
None
0.94A 2avoA-4fe9A:
undetectable
2avoA-4fe9A:
13.39
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.
4fmz INTERNALIN

(Listeria
monocytogenes)
PF12354
(Internalin_N)
PF12799
(LRR_4)
PF13855
(LRR_8)
5 LEU A 343
ILE A 356
ILE A 310
VAL A 339
ILE A 340
None
EDO  A 405 (-3.8A)
None
None
None
0.89A 2avoA-4fmzA:
undetectable
2avoA-4fmzA:
17.06
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.
4gt6 CELL SURFACE PROTEIN

(Faecalibacterium
prausnitzii)
PF13306
(LRR_5)
5 LEU A 148
ILE A  80
GLY A 105
VAL A 151
ILE A 147
None
1.11A 2avoA-4gt6A:
undetectable
2avoA-4gt6A:
13.59
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.
4h0o ACETATE KINASE

(Entamoeba
histolytica)
PF00871
(Acetate_kinase)
5 LEU A 183
GLY A 208
ILE A 195
VAL A 179
ILE A 180
None
0.87A 2avoA-4h0oA:
undetectable
2avoA-4h0oA:
13.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4hci CUPREDOXIN 1

(Bacillus
anthracis)
PF13473
(Cupredoxin_1)
5 LEU A  69
ILE A 127
PRO A  56
VAL A  47
ILE A  45
None
1.10A 2avoA-4hciA:
undetectable
2avoA-4hciA:
21.36
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.
4jwy GLUTAMATE RECEPTOR
IONOTROPIC, NMDA 2D


(Rattus
norvegicus)
PF10613
(Lig_chan-Glu_bd)
5 LEU A 264
ASP A 260
ILE A 112
GLY A 246
ILE A 117
None
1.01A 2avoA-4jwyA:
undetectable
2avoA-4jwyA:
17.29
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.
4mea PREDICTED PROTEIN

(Acinetobacter
nosocomialis)
PF00561
(Abhydrolase_1)
5 ILE A  66
GLY A 141
ILE A 140
PRO A 117
ILE A 114
None
1.10A 2avoA-4meaA:
undetectable
2avoA-4meaA:
14.11
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.
4mk0 BETA-ADRENERGIC
RECEPTOR KINASE 1


(Homo sapiens)
PF00069
(Pkinase)
PF00169
(PH)
PF00615
(RGS)
5 LEU A 279
ILE A 254
GLY A 304
ILE A 302
ILE A 323
None
1.08A 2avoA-4mk0A:
undetectable
2avoA-4mk0A:
10.30
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4njv PROTEASE

(Human
immunodeficiency
virus 1)
PF00077
(RVP)
6 ARG A   8
LEU A  23
ASP A  25
ILE A  47
ILE A  50
ILE A  84
RIT  A 500 (-3.2A)
None
RIT  A 500 (-2.4A)
RIT  A 500 ( 4.5A)
RIT  A 500 (-4.3A)
RIT  A 500 (-4.3A)
0.69A 2avoA-4njvA:
20.4
2avoA-4njvA:
83.84
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4njv PROTEASE

(Human
immunodeficiency
virus 1)
PF00077
(RVP)
7 LEU A  23
ASP A  25
ILE A  47
GLY A  49
ILE A  50
PRO A  81
ILE A  84
None
RIT  A 500 (-2.4A)
RIT  A 500 ( 4.5A)
RIT  A 500 (-3.4A)
RIT  A 500 (-4.3A)
RIT  A 500 (-3.9A)
RIT  A 500 (-4.3A)
0.69A 2avoA-4njvA:
20.4
2avoA-4njvA:
83.84
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.
4pxq D-GLUCURONYL C5
EPIMERASE B


(Danio rerio)
PF06662
(C5-epim_C)
6 LEU A 322
ASP A 325
GLY A 308
ILE A 309
VAL A 276
ILE A 289
None
1.28A 2avoA-4pxqA:
undetectable
2avoA-4pxqA:
10.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4q66 PROTEIN BCH1

(Saccharomyces
cerevisiae)
no annotation 5 LEU K 615
ILE K 668
ILE K 672
VAL K 656
ILE K 659
None
1.09A 2avoA-4q66K:
undetectable
2avoA-4q66K:
9.07
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.
4re2 BETA-MANNOSIDASE/BET
A-GLUCOSIDASE


(Oryza sativa)
PF00232
(Glyco_hydro_1)
5 LEU A 438
ILE A 410
PRO A 466
VAL A 455
ILE A 454
None
1.09A 2avoA-4re2A:
undetectable
2avoA-4re2A:
11.20
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.
4w7s PRE-MRNA-SPLICING
ATP-DEPENDENT RNA
HELICASE PRP28


(Saccharomyces
cerevisiae)
PF00270
(DEAD)
PF00271
(Helicase_C)
5 LEU A 359
ILE A 294
ILE A 259
VAL A 362
ILE A 358
None
1.07A 2avoA-4w7sA:
undetectable
2avoA-4w7sA:
14.90
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.
4xcu FIBROBLAST GROWTH
FACTOR RECEPTOR 4


(Homo sapiens)
PF07714
(Pkinase_Tyr)
5 LEU A 526
ILE A 628
ILE A 609
VAL A 523
ILE A 527
None
0.96A 2avoA-4xcuA:
undetectable
2avoA-4xcuA:
19.41
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.
4xvx ACYL-[ACYL-CARRIER-P
ROTEIN]
DEHYDROGENASE MBTN


(Mycobacterium
tuberculosis)
PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N)
5 LEU A  93
GLY A 119
ILE A 161
VAL A 220
ILE A  92
None
FDA  A 402 ( 4.2A)
None
None
None
1.09A 2avoA-4xvxA:
undetectable
2avoA-4xvxA:
12.97
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4ydf HTLV-1 PROTEASE

(Primate
T-lymphotropic
virus 1)
PF00077
(RVP)
5 ARG A  10
LEU A  30
ASP A  32
GLY A  58
ILE A 100
None
None
4B1  A 201 (-2.9A)
4B1  A 201 (-3.4A)
4B1  A 201 (-4.8A)
0.72A 2avoA-4ydfA:
13.1
2avoA-4ydfA:
31.30
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.
4ywl CELL DIVISION
CONTROL PROTEIN 21


(Pyrococcus
furiosus)
PF14551
(MCM_N)
PF17207
(MCM_OB)
5 ILE A 187
GLY A 205
ILE A 206
VAL A 214
ILE A 249
None
0.86A 2avoA-4ywlA:
undetectable
2avoA-4ywlA:
17.43
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.
5awm STRESS-ACTIVATED
PROTEIN KINASE JNK


(Drosophila
melanogaster)
PF00069
(Pkinase)
5 LEU A 113
ILE A  83
GLY A 136
VAL A 157
ILE A 155
None
1.12A 2avoA-5awmA:
undetectable
2avoA-5awmA:
13.00
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.
5boe ENOLASE

(Staphylococcus
aureus)
PF00113
(Enolase_C)
PF03952
(Enolase_N)
5 ILE A 384
ILE A 347
PRO A  38
VAL A  37
ILE A 118
None
1.04A 2avoA-5boeA:
undetectable
2avoA-5boeA:
15.35
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.
5cxu FERULIC ACID
ESTERASE AMCE1/FAE1A


(Anaeromyces
mucronatus)
PF00756
(Esterase)
5 ARG A  90
LEU A  85
ILE A 258
PRO A  11
ILE A  81
None
1.08A 2avoA-5cxuA:
undetectable
2avoA-5cxuA:
19.25
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.
5dlq EXPORTIN-4

(Mus musculus)
no annotation 5 LEU B 608
ILE B 578
ILE B 660
VAL B 604
ILE B 605
None
0.93A 2avoA-5dlqB:
undetectable
2avoA-5dlqB:
6.81
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.
5h1k GEM-ASSOCIATED
PROTEIN 5


(Homo sapiens)
PF00400
(WD40)
PF12894
(ANAPC4_WD40)
5 LEU A 147
ILE A 175
ILE A 178
VAL A 134
ILE A 149
None
1.11A 2avoA-5h1kA:
undetectable
2avoA-5h1kA:
8.75
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.
5h42 UNCHARACTERIZED
PROTEIN


(Lachnoclostridium
phytofermentans)
PF17167
(Glyco_hydro_36)
5 LEU A 146
GLY A 242
ILE A 243
VAL A 129
ILE A 127
None
1.04A 2avoA-5h42A:
undetectable
2avoA-5h42A:
7.04
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.
5ikb GLUTAMATE RECEPTOR
IONOTROPIC, KAINATE
4,GLUTAMATE RECEPTOR
IONOTROPIC, KAINATE
4


(Rattus
norvegicus)
PF10613
(Lig_chan-Glu_bd)
5 LEU A 235
ASP A 231
GLY A 217
ILE A  91
ILE A 234
None
1.00A 2avoA-5ikbA:
undetectable
2avoA-5ikbA:
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.
5mz9 -

(-)
no annotation 5 LEU A 552
GLY A 387
ILE A 385
VAL A 547
ILE A 395
None
1.10A 2avoA-5mz9A:
undetectable
2avoA-5mz9A:
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.
5n7q PUTATIVE CATHEPSIN D

(Ixodes ricinus)
no annotation 5 LEU A 160
ASP A 316
ILE A 225
GLY A  38
VAL A 158
None
0.93A 2avoA-5n7qA:
6.0
2avoA-5n7qA:
18.95
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.
5n9m COBYRIC ACID
SYNTHASE


(Staphylococcus
aureus)
no annotation 5 LEU A 203
ILE A 135
GLY A 177
ILE A 178
ILE A 199
None
1.05A 2avoA-5n9mA:
undetectable
2avoA-5n9mA:
21.78
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.
5nr1 FTSZ-BINDING PROTEIN
FZLA


(Caulobacter
vibrioides)
PF00043
(GST_C)
PF13417
(GST_N_3)
5 LEU A 176
GLY A 139
PRO A 186
VAL A 185
ILE A 179
None
1.06A 2avoA-5nr1A:
undetectable
2avoA-5nr1A:
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.
5pep PEPSIN

(Sus scrofa)
PF00026
(Asp)
5 LEU A 155
ASP A 304
ILE A 213
GLY A  34
VAL A 153
None
1.09A 2avoA-5pepA:
6.7
2avoA-5pepA:
18.09
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5t2z PROTEASE

(Human
immunodeficiency
virus 1)
PF00077
(RVP)
7 ARG A   8
LEU A  23
ASP A  25
ILE A  47
ILE A  50
PRO A  81
ILE A  84
None
0.87A 2avoA-5t2zA:
19.7
2avoA-5t2zA:
79.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5t2z PROTEASE

(Human
immunodeficiency
virus 1)
PF00077
(RVP)
7 LEU A  23
ASP A  25
ILE A  47
GLY A  49
ILE A  50
PRO A  81
ILE A  84
None
0.71A 2avoA-5t2zA:
19.7
2avoA-5t2zA:
79.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5t5i TUNGSTEN
FORMYLMETHANOFURAN
DEHYDROGENASE
SUBUNIT FWDG


(Methanothermobacter
wolfeii)
PF12838
(Fer4_7)
5 LEU G  60
ILE G  76
PRO G  23
VAL G  24
ILE G  45
None
SF4  G 101 ( 3.8A)
None
None
SF4  G 102 ( 3.9A)
1.06A 2avoA-5t5iG:
undetectable
2avoA-5t5iG:
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.
5xir HEAT SHOCK 70 KDA
PROTEIN 1A


(Homo sapiens)
no annotation 5 LEU A  22
ILE A  41
GLY A 105
PRO A  19
ILE A  35
None
1.08A 2avoA-5xirA:
undetectable
2avoA-5xirA:
19.80
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.
6eki CARBONIC ANHYDRASE

(Persephonella
marina)
no annotation 5 ARG A 247
ILE A 152
GLY A 150
VAL A  63
ILE A  65
None
0.92A 2avoA-6ekiA:
undetectable
2avoA-6ekiA:
22.33
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.
6en4 SPLICING FACTOR 3B
SUBUNIT 3


(Homo sapiens)
no annotation 5 LEU A   6
ILE A 412
ILE A1092
VAL A1112
ILE A1110
None
0.92A 2avoA-6en4A:
undetectable
2avoA-6en4A:
22.12
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6upj HIV-2 PROTEASE

(Human
immunodeficiency
virus 2)
PF00077
(RVP)
6 ARG A   8
LEU A  23
ASP A  25
GLY A  49
ILE A  50
ILE A  84
None
None
NIU  A 100 (-2.8A)
NIU  A 100 ( 3.8A)
NIU  A 100 (-3.9A)
None
0.82A 2avoA-6upjA:
17.6
2avoA-6upjA:
48.48
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6upj HIV-2 PROTEASE

(Human
immunodeficiency
virus 2)
PF00077
(RVP)
6 LEU A  23
ASP A  25
GLY A  49
ILE A  50
PRO A  81
ILE A  84
None
NIU  A 100 (-2.8A)
NIU  A 100 ( 3.8A)
NIU  A 100 (-3.9A)
None
None
0.85A 2avoA-6upjA:
17.6
2avoA-6upjA:
48.48