SIMILAR PATTERNS OF AMINO ACIDS FOR 2AOF_C_FRDC305_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.
1axn ANNEXIN III

(Homo sapiens)
PF00191
(Annexin)
4 ASP A 112
GLY A 235
ALA A 243
ILE A 115
None
0.80A 2aofA-1axnA:
undetectable
2aofA-1axnA:
16.49
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.
1b3q PROTEIN (CHEMOTAXIS
PROTEIN CHEA)


(Thermotoga
maritima)
PF01584
(CheW)
PF02518
(HATPase_c)
PF02895
(H-kinase_dim)
4 GLY A 652
PRO A 559
ALA A 546
ILE A 635
None
0.92A 2aofA-1b3qA:
undetectable
2aofA-1b3qA:
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.
1cp2 NITROGENASE IRON
PROTEIN


(Clostridium
pasteurianum)
PF00142
(Fer4_NifH)
4 GLY A 125
PRO A 135
ALA A 141
ILE A 144
None
0.91A 2aofA-1cp2A:
undetectable
2aofA-1cp2A:
17.60
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.
1d7b CELLOBIOSE
DEHYDROGENASE


(Phanerochaete
chrysosporium)
PF16010
(CDH-cyt)
4 ASP A  68
GLY A  58
PRO A  93
ALA A  87
None
HEM  A 401 (-3.5A)
HEM  A 401 (-4.5A)
None
0.82A 2aofA-1d7bA:
undetectable
2aofA-1d7bA:
22.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1d9z EXCINUCLEASE UVRABC
COMPONENT UVRB


([Bacillus]
caldotenax)
PF00271
(Helicase_C)
PF04851
(ResIII)
PF12344
(UvrB)
4 ASP A 207
GLY A 217
ALA A 242
ILE A 243
None
0.90A 2aofA-1d9zA:
undetectable
2aofA-1d9zA:
9.87
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.
1dcj YHHP PROTEIN

(Escherichia
coli)
PF01206
(TusA)
4 GLY A  54
PRO A  22
ALA A  14
ILE A  41
None
0.89A 2aofA-1dcjA:
undetectable
2aofA-1dcjA:
20.41
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)
4 ASP A  25
GLY A  49
PRO A  81
ILE A  84
A79  A 800 (-2.7A)
A79  A 800 ( 3.7A)
A79  A 800 ( 3.9A)
A79  A 800 (-3.6A)
0.65A 2aofA-1hvcA:
14.0
2aofA-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)
4 ASP A  25
GLY A  49
PRO A  81
ILE A  84
A79  A 800 (-2.8A)
A79  A 800 (-3.4A)
A79  A 800 ( 3.4A)
A79  A 800 (-3.8A)
0.39A 2aofA-1hvcA:
14.0
2aofA-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.
1ktn 2-DEOXYRIBOSE-5-PHOS
PHATE ALDOLASE


(Escherichia
coli)
PF01791
(DeoC)
4 ASP A 102
GLY A 199
PRO A 202
ALA A 203
None
0.95A 2aofA-1ktnA:
undetectable
2aofA-1ktnA:
17.20
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.
1lf9 GLUCOAMYLASE

(Thermoanaerobacterium
thermosaccharolyticum)
PF00723
(Glyco_hydro_15)
PF09137
(Glucodextran_N)
4 ASP A 673
GLY A 607
ALA A 657
ILE A 661
None
0.91A 2aofA-1lf9A:
undetectable
2aofA-1lf9A:
10.68
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.
1nmo HYPOTHETICAL PROTEIN
YBGI


(Escherichia
coli)
PF01784
(NIF3)
4 GLY A 139
PRO A 154
ALA A 213
ILE A 191
None
0.96A 2aofA-1nmoA:
undetectable
2aofA-1nmoA:
18.22
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.
1ope SUCCINYL-COA:3-KETOA
CID-COENZYME A
TRANSFERASE


(Sus scrofa)
PF01144
(CoA_trans)
4 GLY A  90
PRO A 132
ALA A 144
ILE A 143
None
0.92A 2aofA-1opeA:
undetectable
2aofA-1opeA:
15.66
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.
1pcv OSMOTIN

(Nicotiana
tabacum)
PF00314
(Thaumatin)
4 GLY A 118
PRO A 112
ALA A 111
ILE A 123
None
0.81A 2aofA-1pcvA:
undetectable
2aofA-1pcvA:
17.01
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.
1qvz YDR533C PROTEIN

(Saccharomyces
cerevisiae)
PF01965
(DJ-1_PfpI)
4 ASP A 206
GLY A 169
PRO A 221
ALA A 222
None
None
CSO  A 138 ( 4.9A)
None
0.93A 2aofA-1qvzA:
undetectable
2aofA-1qvzA:
20.98
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)
4 ASP A  25
GLY A  48
PRO A  81
ILE A  84
None
0.93A 2aofA-1sivA:
18.6
2aofA-1sivA:
51.96
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)
4 ASP A  25
GLY A  49
PRO A  81
ILE A  84
None
0.36A 2aofA-1sivA:
18.6
2aofA-1sivA:
51.96
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.
1txc PATHOGENESIS-RELATED
CLASS 10 PROTEIN
SPE-16


(Pachyrhizus
erosus)
PF00407
(Bet_v_1)
4 GLY A 139
PRO A  36
ALA A  57
ILE A  55
2AN  A 716 (-3.7A)
2AN  A 715 (-4.4A)
2AN  A 716 (-3.4A)
2AN  A 716 (-4.2A)
0.96A 2aofA-1txcA:
undetectable
2aofA-1txcA:
23.26
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.
1uyv ACETYL-COA
CARBOXYLASE


(Saccharomyces
cerevisiae)
PF01039
(Carboxyl_trans)
4 ASP A1601
GLY A1626
ALA A1712
ILE A1711
None
0.89A 2aofA-1uyvA:
undetectable
2aofA-1uyvA:
8.98
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.
1w6j LANOSTEROL SYNTHASE

(Homo sapiens)
PF13243
(SQHop_cyclase_C)
PF13249
(SQHop_cyclase_N)
4 ASP A 138
GLY A 142
ALA A 176
ILE A 179
None
0.92A 2aofA-1w6jA:
undetectable
2aofA-1w6jA:
7.92
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.
1wiw GLUCOSE-6-PHOSPHATE
ISOMERASE LIKE
PROTEIN


(Thermus
thermophilus)
PF10432
(bact-PGI_C)
4 GLY A  43
PRO A 111
ALA A 110
ILE A 104
None
0.89A 2aofA-1wiwA:
undetectable
2aofA-1wiwA:
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.
1wkb LEUCYL-TRNA
SYNTHETASE


(Pyrococcus
horikoshii)
PF00133
(tRNA-synt_1)
PF08264
(Anticodon_1)
4 GLY A  84
PRO A 122
ALA A  91
ILE A  90
SO4  A 901 (-3.3A)
None
None
None
0.91A 2aofA-1wkbA:
undetectable
2aofA-1wkbA:
10.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2bfr HYPOTHETICAL PROTEIN
AF1521


(Archaeoglobus
fulgidus)
PF01661
(Macro)
4 GLY A  19
PRO A  25
ALA A  26
ILE A  29
None
0.94A 2aofA-2bfrA:
undetectable
2aofA-2bfrA:
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.
2bty ACETYLGLUTAMATE
KINASE


(Thermotoga
maritima)
PF00696
(AA_kinase)
4 GLY A  29
PRO A  64
ALA A  65
ILE A 102
NLG  A1284 (-3.0A)
None
None
None
0.93A 2aofA-2btyA:
undetectable
2aofA-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.
2ctz O-ACETYL-L-HOMOSERIN
E SULFHYDRYLASE


(Thermus
thermophilus)
PF01053
(Cys_Met_Meta_PP)
4 ASP A 221
GLY A 252
ALA A 260
ILE A 257
None
0.93A 2aofA-2ctzA:
undetectable
2aofA-2ctzA:
12.68
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.
2f2a GLUTAMYL-TRNA(GLN)
AMIDOTRANSFERASE
SUBUNIT A


(Staphylococcus
aureus)
PF01425
(Amidase)
4 ASP A  37
GLY A  77
ALA A  32
ILE A  33
None
0.93A 2aofA-2f2aA:
undetectable
2aofA-2f2aA:
12.97
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)
4 ASP A  25
GLY A  55
PRO A  86
ILE A  89
LP1  A 201 (-2.3A)
LP1  A 201 (-3.4A)
LP1  A 201 (-3.9A)
LP1  A 201 (-4.2A)
0.35A 2aofA-2fmbA:
15.0
2aofA-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.
2g0t CONSERVED
HYPOTHETICAL PROTEIN


(Thermotoga
maritima)
PF07755
(DUF1611)
PF17396
(DUF1611_N)
4 GLY A  31
PRO A  41
ALA A  13
ILE A  82
None
0.88A 2aofA-2g0tA:
undetectable
2aofA-2g0tA:
14.33
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.
2i0o SER/THR PHOSPHATASE

(Anopheles
gambiae)
PF00481
(PP2C)
4 ASP A 479
GLY A 470
PRO A 445
ILE A 495
None
0.88A 2aofA-2i0oA:
undetectable
2aofA-2i0oA:
15.03
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.
2iae SERINE/THREONINE-PRO
TEIN PHOSPHATASE 2A
56 KDA REGULATORY
SUBUNIT GAMMA
ISOFORM


(Homo sapiens)
PF01603
(B56)
4 GLY B 191
PRO B 152
ALA B 155
ILE B 159
None
0.90A 2aofA-2iaeB:
undetectable
2aofA-2iaeB:
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.
2jak SERINE/THREONINE-PRO
TEIN PHOSPHATASE 2A
56 KDA REGULATORY
SUBUNIT GAMMA
ISOFORM


(Homo sapiens)
PF01603
(B56)
4 GLY A 191
PRO A 152
ALA A 155
ILE A 159
None
0.95A 2aofA-2jakA:
undetectable
2aofA-2jakA:
16.50
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.
2o3j UDP-GLUCOSE
6-DEHYDROGENASE


(Caenorhabditis
elegans)
PF00984
(UDPG_MGDP_dh)
PF03720
(UDPG_MGDP_dh_C)
PF03721
(UDPG_MGDP_dh_N)
4 ASP A 386
GLY A 281
ALA A 357
ILE A 358
None
0.93A 2aofA-2o3jA:
undetectable
2aofA-2o3jA:
14.48
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)
5 ASP A  25
GLY A  49
PRO A  81
ALA A  82
ILE A  84
AB1  A 501 (-2.4A)
AB1  A 501 (-3.5A)
AB1  A 501 (-4.2A)
AB1  A 501 (-3.6A)
AB1  A 501 ( 4.2A)
0.37A 2aofA-2rkfA:
20.9
2aofA-2rkfA:
83.84
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)
4 GLY A  48
PRO A  81
ALA A  82
ILE A  84
AB1  A 501 (-4.2A)
AB1  A 501 (-4.2A)
AB1  A 501 (-3.6A)
AB1  A 501 ( 4.2A)
0.81A 2aofA-2rkfA:
20.9
2aofA-2rkfA:
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.
2v8n LACTOSE PERMEASE

(Escherichia
coli)
PF01306
(LacY_symp)
4 GLY A 115
PRO A 123
ALA A 124
ILE A  80
None
0.95A 2aofA-2v8nA:
undetectable
2aofA-2v8nA:
12.29
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.
2vun ENAMIDASE

(Eubacterium
barkeri)
PF01979
(Amidohydro_1)
4 GLY A  38
PRO A 327
ALA A 326
ILE A 325
None
0.86A 2aofA-2vunA:
undetectable
2aofA-2vunA:
15.03
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.
2y5j DIHYDROPTEROATE
SYNTHASE


(Burkholderia
cenocepacia)
PF00809
(Pterin_bind)
4 GLY A 140
PRO A 225
ALA A 265
ILE A 266
None
0.85A 2aofA-2y5jA:
undetectable
2aofA-2y5jA:
18.64
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.
3bf0 PROTEASE 4

(Escherichia
coli)
PF01343
(Peptidase_S49)
4 GLY A 411
PRO A 417
ALA A 418
ILE A 421
None
0.67A 2aofA-3bf0A:
undetectable
2aofA-3bf0A:
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.
3bio OXIDOREDUCTASE,
GFO/IDH/MOCA FAMILY


(Porphyromonas
gingivalis)
PF01408
(GFO_IDH_MocA)
PF16654
(DAPDH_C)
4 GLY A 151
PRO A 256
ALA A 257
ILE A 253
None
ACT  A3001 ( 4.1A)
None
None
0.90A 2aofA-3bioA:
undetectable
2aofA-3bioA:
15.13
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.
3f5b AMINOGLYCOSIDE
N(6')ACETYLTRANSFERA
SE


(Legionella
pneumophila)
PF13523
(Acetyltransf_8)
4 ASP A  95
GLY A  42
ALA A  61
ILE A  77
CHX  A 182 (-4.0A)
None
None
None
0.84A 2aofA-3f5bA:
undetectable
2aofA-3f5bA:
19.15
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.
3ff6 ACETYL-COA
CARBOXYLASE 2


(Homo sapiens)
PF01039
(Carboxyl_trans)
4 ASP A1807
GLY A1832
ALA A1915
ILE A1914
None
0.88A 2aofA-3ff6A:
undetectable
2aofA-3ff6A:
8.59
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.
3g25 GLYCEROL KINASE

(Staphylococcus
aureus)
PF00370
(FGGY_N)
PF02782
(FGGY_C)
4 ASP A 294
GLY A 447
ALA A 218
ILE A 293
None
0.92A 2aofA-3g25A:
undetectable
2aofA-3g25A:
15.08
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.
3gka N-ETHYLMALEIMIDE
REDUCTASE


(Burkholderia
pseudomallei)
PF00724
(Oxidored_FMN)
4 GLY A 231
PRO A  31
ALA A  30
ILE A  28
None
FMN  A 362 (-3.6A)
FMN  A 362 (-3.4A)
None
0.78A 2aofA-3gkaA:
undetectable
2aofA-3gkaA:
14.70
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.
3hdc THIOREDOXIN FAMILY
PROTEIN


(Geobacter
metallireducens)
PF00578
(AhpC-TSA)
4 GLY A 130
PRO A  40
ALA A  39
ILE A 146
None
0.95A 2aofA-3hdcA:
undetectable
2aofA-3hdcA:
18.47
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.
3j09 COPPER-EXPORTING
P-TYPE ATPASE A


(Archaeoglobus
fulgidus)
PF00122
(E1-E2_ATPase)
PF00403
(HMA)
PF00702
(Hydrolase)
4 ASP A 424
GLY A 277
PRO A 624
ALA A 625
None
0.60A 2aofA-3j09A:
undetectable
2aofA-3j09A:
8.82
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.
3jzz TYPE IV PILIN
STRUCTURAL SUBUNIT


(Pseudomonas
aeruginosa)
PF00114
(Pilin)
4 GLY A  36
PRO A  42
ALA A  43
ILE A  92
None
0.86A 2aofA-3jzzA:
undetectable
2aofA-3jzzA:
22.38
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.
3kl0 GLUCURONOXYLANASE
XYNC


(Bacillus
subtilis)
PF17189
(Glyco_hydro_30C)
4 ASP A 224
GLY A  18
ALA A 134
ILE A 198
None
0.91A 2aofA-3kl0A:
undetectable
2aofA-3kl0A:
12.66
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)
4 ASP A  25
GLY A  49
PRO A  81
ILE A  84
None
0.37A 2aofA-3mwsA:
20.3
2aofA-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.
3o75 FRUCTOSE TRANSPORT
SYSTEM REPRESSOR
FRUR


(Pseudomonas
putida)
PF00532
(Peripla_BP_1)
4 ASP A 119
GLY A  91
ALA A 304
ILE A 308
None
0.81A 2aofA-3o75A:
undetectable
2aofA-3o75A:
17.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3rv6 ISOCHORISMATE
SYNTHASE/ISOCHORISMA
TE-PYRUVATE LYASE
MBTI


(Mycobacterium
tuberculosis)
PF00425
(Chorismate_bind)
4 ASP A 378
GLY A 421
ALA A 373
ILE A 374
None
VAE  A 451 ( 4.2A)
None
None
0.91A 2aofA-3rv6A:
undetectable
2aofA-3rv6A:
12.32
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.
3sy8 ROCR

(Pseudomonas
aeruginosa)
PF00072
(Response_reg)
PF00563
(EAL)
4 GLY A 391
PRO A 162
ALA A 174
ILE A 228
None
0.80A 2aofA-3sy8A:
undetectable
2aofA-3sy8A:
12.50
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)
4 ASP A  25
GLY A  49
PRO A  81
ALA A  82
017  A 201 (-2.6A)
017  A 201 (-4.0A)
None
SO4  A 101 (-3.5A)
0.67A 2aofA-3t3cA:
18.6
2aofA-3t3cA:
75.76
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)
4 ASP A  25
GLY A  49
PRO A  81
ILE A  84
017  A 201 (-2.6A)
017  A 201 (-3.0A)
017  A 201 (-4.1A)
017  A 201 (-4.7A)
0.34A 2aofA-3ttpA:
19.8
2aofA-3ttpA:
76.77
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.
3wnp CYCLOISOMALTOOLIGOSA
CCHARIDE
GLUCANOTRANSFERASE


(Bacillus
circulans)
PF13199
(Glyco_hydro_66)
PF16990
(CBM_35)
4 GLY A 420
PRO A 465
ALA A 464
ILE A 462
None
0.91A 2aofA-3wnpA:
undetectable
2aofA-3wnpA:
9.27
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.
3zre THIOL PEROXIDASE

(Yersinia
pseudotuberculosis)
PF08534
(Redoxin)
4 ASP A  57
GLY A  96
ALA A  62
ILE A  56
None
0.95A 2aofA-3zreA:
undetectable
2aofA-3zreA:
18.59
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.
3zz1 BETA-D-GLUCOSIDE
GLUCOHYDROLASE


(Trichoderma
reesei)
PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C)
PF14310
(Fn3-like)
4 GLY A 574
PRO A 569
ALA A 533
ILE A 532
None
0.92A 2aofA-3zz1A:
undetectable
2aofA-3zz1A:
9.71
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.
4a01 PROTON
PYROPHOSPHATASE


(Vigna radiata)
PF03030
(H_PPase)
4 ASP A   8
GLY A 316
PRO A 385
ALA A   4
None
0.93A 2aofA-4a01A:
undetectable
2aofA-4a01A:
10.22
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.
4dg8 PA1221

(Pseudomonas
aeruginosa)
PF00501
(AMP-binding)
4 ASP A 400
GLY A 306
ALA A 363
ILE A 361
AMP  A 701 (-2.6A)
AMP  A 701 (-4.7A)
None
None
0.91A 2aofA-4dg8A:
undetectable
2aofA-4dg8A:
11.46
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.
4f2a CHOLESTERYL ESTER
TRANSFER PROTEIN


(Homo sapiens)
PF01273
(LBP_BPI_CETP)
PF02886
(LBP_BPI_CETP_C)
4 GLY A 256
PRO A  18
ALA A  19
ILE A  15
None
None
None
2OB  A 605 (-3.8A)
0.87A 2aofA-4f2aA:
undetectable
2aofA-4f2aA:
12.99
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.
4gvl TRKA DOMAIN PROTEIN

(Geobacter
sulfurreducens)
PF02080
(TrkA_C)
PF02254
(TrkA_N)
4 GLY A 502
PRO A 524
ALA A 523
ILE A 521
None
0.92A 2aofA-4gvlA:
undetectable
2aofA-4gvlA:
11.58
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.
4h7u PYRANOSE
DEHYDROGENASE


(Leucoagaricus
meleagris)
PF00732
(GMC_oxred_N)
PF05199
(GMC_oxred_C)
4 ASP A 198
GLY A 162
ALA A 171
ILE A 156
None
0.93A 2aofA-4h7uA:
undetectable
2aofA-4h7uA:
12.16
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.
4hn9 IRON COMPLEX
TRANSPORT SYSTEM
SUBSTRATE-BINDING
PROTEIN


([Eubacterium]
eligens)
PF01497
(Peripla_BP_2)
4 ASP A  93
GLY A 350
PRO A 113
ALA A 114
None
0.77A 2aofA-4hn9A:
undetectable
2aofA-4hn9A:
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.
4igl YENB

(Yersinia
entomophaga)
PF03534
(SpvB)
PF12255
(TcdB_toxin_midC)
PF12256
(TcdB_toxin_midN)
4 GLY A 158
PRO A 188
ALA A 183
ILE A 191
None
0.94A 2aofA-4iglA:
undetectable
2aofA-4iglA:
6.17
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.
4iws PA0254

(Pseudomonas
aeruginosa)
PF01977
(UbiD)
4 GLY A 152
PRO A  67
ALA A  68
ILE A 321
None
0.84A 2aofA-4iwsA:
undetectable
2aofA-4iwsA:
11.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4jgb PUTATIVE EXPORTED
PROTEIN


(Burkholderia
pseudomallei)
PF13460
(NAD_binding_10)
4 GLY A  11
PRO A 158
ALA A 157
ILE A 156
SO4  A 302 (-3.3A)
None
None
None
0.79A 2aofA-4jgbA:
undetectable
2aofA-4jgbA:
18.78
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.
4jgb PUTATIVE EXPORTED
PROTEIN


(Burkholderia
pseudomallei)
PF13460
(NAD_binding_10)
4 GLY A  14
PRO A 158
ALA A 157
ILE A 156
None
0.77A 2aofA-4jgbA:
undetectable
2aofA-4jgbA:
18.78
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.
4n0q LEU/ILE/VAL-BINDING
PROTEIN HOMOLOG 3


(Brucella
melitensis)
PF13458
(Peripla_BP_6)
4 GLY A 102
PRO A  32
ALA A  31
ILE A  30
None
0.95A 2aofA-4n0qA:
undetectable
2aofA-4n0qA:
14.71
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.
4n2p PROTEIN ARCHEASE

(Pyrococcus
horikoshii)
PF01951
(Archease)
4 ASP A  83
GLY A  20
ALA A  31
ILE A  32
None
0.96A 2aofA-4n2pA:
undetectable
2aofA-4n2pA:
21.68
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)
4 ASP A  25
GLY A  49
PRO A  81
ILE A  84
RIT  A 500 (-2.4A)
RIT  A 500 (-3.4A)
RIT  A 500 (-3.9A)
RIT  A 500 (-4.3A)
0.35A 2aofA-4njvA:
21.1
2aofA-4njvA:
84.85
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.
4o48 UNCHARACTERIZED
PROTEIN


(Cavia porcellus)
PF01112
(Asparaginase_2)
4 ASP A 199
GLY A  10
ALA A 231
ILE A 225
ASP  A 402 (-3.0A)
None
None
None
0.96A 2aofA-4o48A:
undetectable
2aofA-4o48A:
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.
4ovk PERIPLASMIC BINDING
PROTEIN


(Veillonella
parvula)
PF01497
(Peripla_BP_2)
4 GLY A 318
PRO A 297
ALA A 296
ILE A 260
None
0.82A 2aofA-4ovkA:
undetectable
2aofA-4ovkA:
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.
4p56 PUTATIVE
EXTRACELLULAR
SOLUTE-BINDING
PROTEIN


(Bordetella
bronchiseptica)
PF03480
(DctP)
4 ASP A 340
GLY A 147
ALA A 120
ILE A 336
None
0.85A 2aofA-4p56A:
undetectable
2aofA-4p56A:
17.04
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.
4q8h PAB-DEPENDENT
POLY(A)-SPECIFIC
RIBONUCLEASE SUBUNIT
PAN2


(Saccharomyces
cerevisiae)
PF00929
(RNase_T)
PF13423
(UCH_1)
4 ASP A 959
GLY A 977
ALA A1072
ILE A1069
None
0.94A 2aofA-4q8hA:
undetectable
2aofA-4q8hA:
9.23
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.
4qnw CHANOCLAVINE-I
ALDEHYDE REDUCTASE


(Aspergillus
fumigatus)
PF00724
(Oxidored_FMN)
4 GLY A 223
PRO A  29
ALA A  28
ILE A  26
None
FMN  A 401 (-3.7A)
FMN  A 401 (-3.4A)
None
0.68A 2aofA-4qnwA:
undetectable
2aofA-4qnwA:
14.32
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.
4rs3 ABC TRANSPORTER,
CARBOHYDRATE UPTAKE
TRANSPORTER-2 (CUT2)
FAMILY, PERIPLASMIC
SUGAR-BINDING
PROTEIN


(Mycolicibacterium
smegmatis)
PF13407
(Peripla_BP_4)
4 ASP A 249
GLY A 163
ALA A 140
ILE A 248
XYL  A 401 (-2.7A)
None
None
None
0.85A 2aofA-4rs3A:
undetectable
2aofA-4rs3A:
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.
4rsm PERIPLASMIC BINDING
PROTEIN/LACI
TRANSCRIPTIONAL
REGULATOR


(Mycolicibacterium
smegmatis)
PF13407
(Peripla_BP_4)
4 ASP A 249
GLY A 163
ALA A 140
ILE A 248
3VB  A 401 (-2.7A)
None
None
None
0.86A 2aofA-4rsmA:
undetectable
2aofA-4rsmA:
15.58
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.
4tr4 TYPE III
IODOTHYRONINE
DEIODINASE


(Mus musculus)
PF00837
(T4_deiodinase)
4 GLY A 255
PRO A 136
ALA A 135
ILE A 269
None
0.91A 2aofA-4tr4A:
undetectable
2aofA-4tr4A:
18.85
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.
4wwv AMINOPEPTIDASE FROM
FAMILY M42


(Desulfurococcus
amylolyticus)
PF05343
(Peptidase_M42)
4 ASP A 231
GLY A  61
ALA A 354
ILE A 359
None
0.77A 2aofA-4wwvA:
undetectable
2aofA-4wwvA:
14.17
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.
5ax0 RHODOPSIN I

(Acetabularia
acetabulum)
PF01036
(Bac_rhodopsin)
4 ASP A 204
GLY A  67
ALA A  15
ILE A 207
None
0.92A 2aofA-5ax0A:
undetectable
2aofA-5ax0A:
21.83
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.
5bwd BENZYLSUCCINATE
SYNTHASE ALPHA CHAIN


(Thauera
aromatica)
PF01228
(Gly_radical)
PF02901
(PFL-like)
4 ASP A 733
GLY A 706
PRO A 517
ALA A 518
None
0.71A 2aofA-5bwdA:
undetectable
2aofA-5bwdA:
8.43
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.
5bz3 NA(+)/H(+)
ANTIPORTER


(Thermus
thermophilus)
PF00999
(Na_H_Exchanger)
4 GLY A 217
PRO A 260
ALA A 263
ILE A 264
None
0.89A 2aofA-5bz3A:
undetectable
2aofA-5bz3A:
15.22
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.
5c04 PUTATIVE
PEROXIREDOXIN MT2298


(Mycobacterium
tuberculosis)
PF00578
(AhpC-TSA)
4 GLY A 105
PRO A   9
ALA A   8
ILE A 127
None
0.92A 2aofA-5c04A:
undetectable
2aofA-5c04A:
21.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5c5y DEOXYRIBOSE-PHOSPHAT
E ALDOLASE


(Colwellia
psychrerythraea)
PF01791
(DeoC)
4 ASP A 102
GLY A 196
PRO A 199
ALA A 200
UNL  A 301 ( 4.9A)
None
None
UNL  A 301 ( 4.2A)
0.95A 2aofA-5c5yA:
undetectable
2aofA-5c5yA:
18.60
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.
5eco JASMONIC ACID-AMIDO
SYNTHETASE JAR1


(Arabidopsis
thaliana)
PF03321
(GH3)
4 GLY A  91
PRO A  95
ALA A  96
ILE A  97
None
0.95A 2aofA-5ecoA:
undetectable
2aofA-5ecoA:
10.43
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.
5ept PEROXIREDOXIN TSA2

(Saccharomyces
cerevisiae)
no annotation 4 GLY H 113
PRO H  10
ALA H   9
ILE H 135
None
0.88A 2aofA-5eptH:
undetectable
2aofA-5eptH:
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.
5fjj BETA-GLUCOSIDASE

(Aspergillus
oryzae)
PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C)
PF14310
(Fn3-like)
4 ASP A 730
GLY A 320
ALA A 738
ILE A 734
None
NAG  A1301 (-3.6A)
None
None
0.83A 2aofA-5fjjA:
undetectable
2aofA-5fjjA:
7.78
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.
5i51 TRANSKETOLASE

(Scheffersomyces
stipitis)
PF00456
(Transketolase_N)
PF02779
(Transket_pyr)
PF02780
(Transketolase_C)
4 ASP A 183
GLY A 249
PRO A  36
ALA A  37
None
0.84A 2aofA-5i51A:
undetectable
2aofA-5i51A:
9.82
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.
5i6g ACETYL-COA
CARBOXYLASE-LIKE
PROTEIN,ACETYL-COA
CARBOXYLASE-LIKE
PROTEIN


(Chaetomium
thermophilum)
PF01039
(Carboxyl_trans)
PF08326
(ACC_central)
4 ASP A1646
GLY A1671
ALA A1752
ILE A1751
None
0.88A 2aofA-5i6gA:
undetectable
2aofA-5i6gA:
6.75
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.
5i6h ACETYL-COA
CARBOXYLASE-LIKE
PROTEIN


(Chaetomium
thermophilum)
PF01039
(Carboxyl_trans)
PF08326
(ACC_central)
4 ASP A1646
GLY A1671
ALA A1752
ILE A1751
None
0.85A 2aofA-5i6hA:
undetectable
2aofA-5i6hA:
6.79
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.
5i6i ACETYL-COA
CARBOXYLASE-LIKE
PROTEIN,ACETYL-COA
CARBOXYLASE-LIKE
PROTEIN,ACETYL-COA
CARBOXYLASE-LIKE
PROTEIN


(Chaetomium
thermophilum)
PF01039
(Carboxyl_trans)
PF08326
(ACC_central)
4 ASP A1646
GLY A1671
ALA A1752
ILE A1751
None
0.84A 2aofA-5i6iA:
undetectable
2aofA-5i6iA:
4.66
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.
5jja SERINE/THREONINE-PRO
TEIN PHOSPHATASE 2A
56 KDA REGULATORY
SUBUNIT GAMMA
ISOFORM


(Homo sapiens)
PF01603
(B56)
4 GLY A 191
PRO A 152
ALA A 155
ILE A 159
GLY  A 191 ( 0.0A)
PRO  A 152 ( 1.1A)
ALA  A 155 ( 0.0A)
ILE  A 159 ( 0.7A)
0.88A 2aofA-5jjaA:
undetectable
2aofA-5jjaA:
16.72
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)
4 ASP A  25
GLY A  49
PRO A  81
ILE A  84
None
0.34A 2aofA-5t2zA:
20.2
2aofA-5t2zA:
80.81
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.
5t5i TUNGSTEN-CONTAINING
FORMYLMETHANOFURAN
DEHYDROGENASE 2
SUBUNIT C


(Methanothermobacter
wolfeii)
PF01493
(GXGXG)
4 GLY C 221
PRO C 270
ALA C 269
ILE C 268
None
0.90A 2aofA-5t5iC:
undetectable
2aofA-5t5iC:
18.85
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.
5t9t PROTOCADHERIN GAMMA
B2-ALPHA C


(Mus musculus)
PF00028
(Cadherin)
PF08266
(Cadherin_2)
4 ASP A 448
GLY A 508
ALA A 504
ILE A 457
CA  A 612 (-2.5A)
None
None
None
0.90A 2aofA-5t9tA:
undetectable
2aofA-5t9tA:
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.
5tcb PELA

(Pseudomonas
aeruginosa)
PF03537
(Glyco_hydro_114)
4 GLY A 295
PRO A 284
ALA A 258
ILE A 259
None
0.83A 2aofA-5tcbA:
undetectable
2aofA-5tcbA:
13.83
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.
5u2g PENICILLIN-BINDING
PROTEIN 1A


(Haemophilus
influenzae)
PF00905
(Transpeptidase)
PF00912
(Transgly)
PF17092
(PCB_OB)
4 ASP A 756
GLY A 432
PRO A 410
ALA A 411
CL  A 909 ( 4.5A)
None
None
None
0.95A 2aofA-5u2gA:
undetectable
2aofA-5u2gA:
8.90
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.
5u99 ATP
PHOSPHORIBOSYLTRANSF
ERASE


(Mycobacterium
tuberculosis)
PF01634
(HisG)
PF08029
(HisG_C)
4 GLY A 147
PRO A  97
ALA A  96
ILE A 152
None
0.90A 2aofA-5u99A:
undetectable
2aofA-5u99A:
17.27
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.
5x6o DNA DAMAGE
CHECKPOINT PROTEIN
LCD1


(Saccharomyces
cerevisiae)
no annotation 4 ASP G 497
GLY G 526
ALA G 534
ILE G 537
None
0.89A 2aofA-5x6oG:
undetectable
2aofA-5x6oG:
22.52
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.
6acd -

(-)
no annotation 4 GLY A 418
PRO A 399
ALA A 398
ILE A 397
None
0.91A 2aofA-6acdA:
undetectable
2aofA-6acdA:
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.
6bz0 DIHYDROLIPOYL
DEHYDROGENASE


(Acinetobacter
baumannii)
no annotation 4 GLY A 385
PRO A 421
ALA A 422
ILE A 426
None
0.92A 2aofA-6bz0A:
undetectable
2aofA-6bz0A:
23.58
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)
4 ASP A  25
GLY A  49
PRO A  81
ILE A  84
NIU  A 100 (-2.8A)
NIU  A 100 ( 3.8A)
None
None
0.61A 2aofA-6upjA:
18.2
2aofA-6upjA:
49.49