SIMILAR PATTERNS OF AMINO ACIDS FOR 6F3M_D_ADND502_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.
1aep APOLIPOPHORIN III

(Locusta
migratoria)
no annotation 4 ILE A 115
GLN A 120
THR A 119
LEU A  14
None
1.14A 6f3mD-1aepA:
undetectable
6f3mD-1aepA:
17.67
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.
1cpy SERINE
CARBOXYPEPTIDASE


(Saccharomyces
cerevisiae)
PF00450
(Peptidase_S10)
4 ILE A  91
GLN A  95
THR A  18
LEU A  62
None
1.13A 6f3mD-1cpyA:
undetectable
6f3mD-1cpyA:
23.03
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.
1dl2 CLASS I
ALPHA-1,2-MANNOSIDAS
E


(Saccharomyces
cerevisiae)
PF01532
(Glyco_hydro_47)
4 ILE A 181
THR A 179
THR A 209
LEU A 244
None
1.01A 6f3mD-1dl2A:
undetectable
6f3mD-1dl2A:
21.75
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.
1f0i PHOSPHOLIPASE D

(Streptomyces
sp. PMF)
PF13091
(PLDc_2)
4 ILE A 186
GLN A  51
THR A  52
THR A 183
None
0.86A 6f3mD-1f0iA:
undetectable
6f3mD-1f0iA:
22.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1f26 NITRIC OXIDE
REDUCTASE


(Fusarium
oxysporum)
PF00067
(p450)
4 ILE A 353
GLN A  97
THR A 104
LEU A 157
HEM  A 501 ( 4.5A)
None
None
None
1.01A 6f3mD-1f26A:
undetectable
6f3mD-1f26A:
21.68
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.
1f8w NADH PEROXIDASE

(Enterococcus
faecalis)
PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2)
4 ILE A 414
GLN A 445
THR A 383
LEU A 387
None
1.13A 6f3mD-1f8wA:
3.8
6f3mD-1f8wA:
23.23
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.
1jf5 ALPHA AMYLASE II

(Thermoactinomyces
vulgaris)
PF00128
(Alpha-amylase)
PF02903
(Alpha-amylase_N)
PF16657
(Malt_amylase_C)
4 ILE A 580
THR A 445
THR A 558
LEU A 573
None
1.06A 6f3mD-1jf5A:
2.2
6f3mD-1jf5A:
22.34
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.
1p4p OUTER SURFACE
PROTEIN B


(Borreliella
burgdorferi)
PF00820
(Lipoprotein_1)
4 ILE A 248
GLN A 270
THR A 255
LEU A 291
None
1.14A 6f3mD-1p4pA:
undetectable
6f3mD-1p4pA:
19.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1qnl ALIPHATIC AMIDASE
EXPRESSION-REGULATIN
G PROTEIN


(Pseudomonas
aeruginosa)
PF13433
(Peripla_BP_5)
4 ILE A  10
GLN A 292
THR A 293
LEU A  13
None
1.04A 6f3mD-1qnlA:
2.1
6f3mD-1qnlA:
22.56
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.
1qvb BETA-GLYCOSIDASE

(Thermosphaera
aggregans)
PF00232
(Glyco_hydro_1)
4 ILE A 263
THR A 385
THR A 205
LEU A 313
None
1.08A 6f3mD-1qvbA:
undetectable
6f3mD-1qvbA:
20.41
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.
1ujj ADP-RIBOSYLATION
FACTOR BINDING
PROTEIN GGA1


(Homo sapiens)
PF00790
(VHS)
4 GLN A  36
THR A   9
THR A  18
LEU A  51
None
1.00A 6f3mD-1ujjA:
undetectable
6f3mD-1ujjA:
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.
1un9 DIHYDROXYACETONE
KINASE


(Citrobacter
freundii)
PF02733
(Dak1)
PF02734
(Dak2)
4 ILE A  40
GLN A  96
THR A  93
LEU A  46
None
1.15A 6f3mD-1un9A:
undetectable
6f3mD-1un9A:
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.
1uwi BETA-GALACTOSIDASE

(Sulfolobus
solfataricus)
PF00232
(Glyco_hydro_1)
4 ILE A 261
THR A 386
THR A 203
LEU A 314
None
0.96A 6f3mD-1uwiA:
undetectable
6f3mD-1uwiA:
21.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1v95 NUCLEAR RECEPTOR
COACTIVATOR 5


(Homo sapiens)
PF03129
(HGTP_anticodon)
5 ILE A  67
GLN A  69
THR A  20
THR A  78
LEU A  49
None
1.49A 6f3mD-1v95A:
undetectable
6f3mD-1v95A:
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.
1w8o BACTERIAL SIALIDASE

(Micromonospora
viridifaciens)
PF00754
(F5_F8_type_C)
PF10633
(NPCBM_assoc)
PF13088
(BNR_2)
4 ILE A 143
THR A  73
THR A 140
LEU A 221
None
1.12A 6f3mD-1w8oA:
undetectable
6f3mD-1w8oA:
21.75
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.
1wcz GLUTAMYL
ENDOPEPTIDASE


(Staphylococcus
aureus)
PF13365
(Trypsin_2)
4 ILE A 181
GLN A 124
THR A 123
THR A 130
None
0.99A 6f3mD-1wczA:
undetectable
6f3mD-1wczA:
20.13
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.
1wkb LEUCYL-TRNA
SYNTHETASE


(Pyrococcus
horikoshii)
PF00133
(tRNA-synt_1)
PF08264
(Anticodon_1)
4 ILE A 163
THR A 516
THR A 533
LEU A 170
None
0.87A 6f3mD-1wkbA:
undetectable
6f3mD-1wkbA:
21.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1wz2 LEUCYL-TRNA
SYNTHETASE


(Pyrococcus
horikoshii)
PF00133
(tRNA-synt_1)
PF08264
(Anticodon_1)
4 ILE A 163
THR A 516
THR A 533
LEU A 170
None
0.85A 6f3mD-1wz2A:
undetectable
6f3mD-1wz2A:
19.14
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.
1xje RIBONUCLEOTIDE
REDUCTASE,
B12-DEPENDENT


(Thermotoga
maritima)
PF00317
(Ribonuc_red_lgN)
PF02867
(Ribonuc_red_lgC)
4 ILE A 494
THR A 491
THR A  93
LEU A 365
GDP  A1002 (-3.9A)
GDP  A1002 (-4.7A)
None
None
1.08A 6f3mD-1xjeA:
undetectable
6f3mD-1xjeA:
21.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1xrs D-LYSINE
5,6-AMINOMUTASE
ALPHA SUBUNIT


(Acetoanaerobium
sticklandii)
PF09043
(Lys-AminoMut_A)
4 ILE A 265
GLN A 279
THR A 275
THR A 476
None
1.12A 6f3mD-1xrsA:
2.1
6f3mD-1xrsA:
22.34
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.
2a81 CARB

(Pectobacterium
carotovorum)
PF00378
(ECH_1)
4 GLN A 220
THR A 221
THR A 148
LEU A  91
None
1.08A 6f3mD-2a81A:
undetectable
6f3mD-2a81A:
20.22
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.
2be1 SERINE/THREONINE-PRO
TEIN
KINASE/ENDORIBONUCLE
ASE IRE1


(Saccharomyces
cerevisiae)
no annotation 4 ILE A 155
GLN A 394
THR A 395
LEU A 169
None
1.05A 6f3mD-2be1A:
undetectable
6f3mD-2be1A:
21.79
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.
2fno AGR_PAT_752P

(Agrobacterium
fabrum)
no annotation 4 ILE A 137
THR A 190
THR A 169
LEU A 149
None
1.12A 6f3mD-2fnoA:
undetectable
6f3mD-2fnoA:
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.
2g7z CONSERVED
HYPOTHETICAL PROTEIN
SPY1493


(Streptococcus
pyogenes)
PF02645
(DegV)
4 ILE A 263
GLN A 122
THR A 259
LEU A 192
HXA  A9136 (-4.2A)
None
HXA  A9136 ( 3.7A)
None
0.97A 6f3mD-2g7zA:
undetectable
6f3mD-2g7zA:
22.27
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.
2gjx BETA-HEXOSAMINIDASE
ALPHA CHAIN


(Homo sapiens)
PF00728
(Glyco_hydro_20)
PF14845
(Glycohydro_20b2)
4 ILE A 161
GLN A 144
THR A 141
THR A  32
None
None
None
NAG  A   4 (-3.4A)
1.14A 6f3mD-2gjxA:
undetectable
6f3mD-2gjxA:
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.
2gk1 BETA-HEXOSAMINIDASE
SUBUNIT ALPHA


(Homo sapiens)
PF00728
(Glyco_hydro_20)
PF14845
(Glycohydro_20b2)
no annotation
4 ILE I 161
GLN I 144
THR I 141
THR A  32
None
None
None
NAG  A   4 (-4.0A)
1.10A 6f3mD-2gk1I:
undetectable
6f3mD-2gk1I:
21.80
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.
2j0u ATP-DEPENDENT RNA
HELICASE DDX48


(Homo sapiens)
PF00270
(DEAD)
PF00271
(Helicase_C)
4 ILE A 181
GLN A 213
THR A 212
LEU A 100
None
1.00A 6f3mD-2j0uA:
undetectable
6f3mD-2j0uA:
21.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2k1g LIPOPROTEIN SPR

(Escherichia
coli)
PF00877
(NLPC_P60)
4 ILE A 122
GLN A  79
THR A  75
THR A 105
None
0.91A 6f3mD-2k1gA:
undetectable
6f3mD-2k1gA:
13.33
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.
2k3x CHROMATIN
MODIFICATION-RELATED
PROTEIN EAF3


(Saccharomyces
cerevisiae)
PF11717
(Tudor-knot)
4 ILE A  56
GLN A  51
THR A  53
LEU A  10
None
1.15A 6f3mD-2k3xA:
undetectable
6f3mD-2k3xA:
15.56
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.
2pq6 UDP-GLUCURONOSYL/UDP
-GLUCOSYLTRANSFERASE


(Medicago
truncatula)
PF00201
(UDPGT)
4 ILE A  14
THR A 131
THR A  44
LEU A  91
None
1.08A 6f3mD-2pq6A:
4.0
6f3mD-2pq6A:
21.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qxl HEAT SHOCK PROTEIN
HOMOLOG SSE1


(Saccharomyces
cerevisiae)
PF00012
(HSP70)
4 ILE A  72
GLN A 117
THR A 116
LEU A  92
None
1.14A 6f3mD-2qxlA:
undetectable
6f3mD-2qxlA:
23.42
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.
2ze4 PHOSPHOLIPASE D

(Streptomyces
antibioticus)
PF13091
(PLDc_2)
4 ILE A 184
GLN A  49
THR A  50
THR A 181
None
0.89A 6f3mD-2ze4A:
undetectable
6f3mD-2ze4A:
22.41
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ce6 ADENOSYLHOMOCYSTEINA
SE


(Mycobacterium
tuberculosis)
PF00670
(AdoHcyase_NAD)
PF05221
(AdoHcyase)
4 GLN A  73
THR A  74
THR A 219
LEU A 407
ADN  A 500 (-3.6A)
ADN  A 500 (-4.5A)
NAD  A 550 ( 2.8A)
NAD  A 550 (-4.2A)
0.60A 6f3mD-3ce6A:
52.3
6f3mD-3ce6A:
48.86
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.
3f2b DNA-DIRECTED DNA
POLYMERASE III ALPHA
CHAIN


(Geobacillus
kaustophilus)
PF02811
(PHP)
PF07733
(DNA_pol3_alpha)
PF14579
(HHH_6)
4 ILE A1054
THR A 990
THR A1083
LEU A1094
None
1.04A 6f3mD-3f2bA:
undetectable
6f3mD-3f2bA:
18.83
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3g1u ADENOSYLHOMOCYSTEINA
SE


(Leishmania
major)
PF00670
(AdoHcyase_NAD)
PF05221
(AdoHcyase)
4 GLN A  56
THR A  57
THR A 156
LEU A 343
ADN  A 438 (-3.8A)
ADN  A 438 (-4.6A)
NAD  A 439 ( 3.0A)
NAD  A 439 ( 4.0A)
0.57A 6f3mD-3g1uA:
54.7
6f3mD-3g1uA:
55.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3g25 GLYCEROL KINASE

(Staphylococcus
aureus)
PF00370
(FGGY_N)
PF02782
(FGGY_C)
4 ILE A 312
GLN A 327
THR A 379
LEU A 319
None
1.08A 6f3mD-3g25A:
undetectable
6f3mD-3g25A:
23.20
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3glq ADENOSYLHOMOCYSTEINA
SE


(Burkholderia
pseudomallei)
PF00670
(AdoHcyase_NAD)
PF05221
(AdoHcyase)
4 GLN A  66
THR A  67
THR A 200
LEU A 385
RAB  A 602 (-3.9A)
RAB  A 602 (-4.5A)
NAD  A 601 ( 2.9A)
NAD  A 601 ( 4.1A)
0.50A 6f3mD-3glqA:
53.9
6f3mD-3glqA:
50.09
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.
3gtd FUMARATE HYDRATASE
CLASS II


(Rickettsia
prowazekii)
PF00206
(Lyase_1)
PF10415
(FumaraseC_C)
4 ILE A 215
GLN A 159
THR A 156
LEU A 288
None
1.09A 6f3mD-3gtdA:
undetectable
6f3mD-3gtdA:
21.92
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.
3gzd SELENOCYSTEINE LYASE

(Homo sapiens)
PF00266
(Aminotran_5)
4 ILE C 193
GLN C 174
THR C 175
LEU C 248
None
1.02A 6f3mD-3gzdC:
undetectable
6f3mD-3gzdC:
22.88
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3h9u ADENOSYLHOMOCYSTEINA
SE


(Trypanosoma
brucei)
PF00670
(AdoHcyase_NAD)
PF05221
(AdoHcyase)
4 GLN A  56
THR A  57
THR A 156
LEU A 343
ADN  A 439 (-3.6A)
ADN  A 439 (-4.7A)
NAD  A 438 (-3.8A)
NAD  A 438 (-4.0A)
0.40A 6f3mD-3h9uA:
56.9
6f3mD-3h9uA:
56.17
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.
3iby FERROUS IRON
TRANSPORT PROTEIN B


(Legionella
pneumophila)
PF02421
(FeoB_N)
4 ILE A  50
THR A   2
THR A  22
LEU A   6
None
1.09A 6f3mD-3ibyA:
2.2
6f3mD-3ibyA:
20.22
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.
3j4j TRANSLATION
INITIATION FACTOR
IF-2


(Thermus
thermophilus)
PF00009
(GTP_EFTU)
PF04760
(IF2_N)
PF11987
(IF-2)
4 ILE A 149
GLN A 160
THR A 161
LEU A  90
None
1.15A 6f3mD-3j4jA:
undetectable
6f3mD-3j4jA:
23.73
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.
3k8p PROTEIN TRANSPORT
PROTEIN SEC39


(Saccharomyces
cerevisiae)
PF08314
(Sec39)
4 ILE D 577
GLN D 621
THR D 618
THR D 588
None
1.03A 6f3mD-3k8pD:
undetectable
6f3mD-3k8pD:
20.22
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.
3k9y 1,25-DIHYDROXYVITAMI
N D(3)
24-HYDROXYLASE,
MITOCHONDRIAL


(Rattus
norvegicus)
PF00067
(p450)
4 ILE A 338
GLN A 349
THR A 388
LEU A 507
None
0.97A 6f3mD-3k9yA:
undetectable
6f3mD-3k9yA:
20.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3kx2 PRE-MRNA-SPLICING
FACTOR ATP-DEPENDENT
RNA HELICASE PRP43


(Saccharomyces
cerevisiae)
no annotation 4 ILE B 176
GLN B 147
THR B 192
LEU B 168
None
MG  B 800 ( 4.8A)
None
None
1.12A 6f3mD-3kx2B:
undetectable
6f3mD-3kx2B:
21.99
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.
3m19 VARIABLE LYMPHOCYTE
RECEPTOR A DIVERSITY
REGION


(Petromyzon
marinus)
PF13855
(LRR_8)
4 ILE A  32
THR A  36
THR A  53
LEU A  65
None
0.87A 6f3mD-3m19A:
undetectable
6f3mD-3m19A:
20.68
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.
3mbe TCR 21.3 ALPHA CHAIN

(Mus musculus)
PF07686
(V-set)
PF09291
(DUF1968)
4 ILE C 191
THR C 173
THR C 154
LEU C 178
None
1.13A 6f3mD-3mbeC:
undetectable
6f3mD-3mbeC:
18.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3myx UNCHARACTERIZED
PROTEIN PSPTO_0244


(Pseudomonas
syringae group
genomosp. 3)
PF05899
(Cupin_3)
4 ILE A 126
GLN A  99
THR A  98
THR A  76
None
EDO  A 239 (-3.5A)
None
None
1.06A 6f3mD-3myxA:
undetectable
6f3mD-3myxA:
21.21
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3n58 ADENOSYLHOMOCYSTEINA
SE


(Brucella
abortus)
PF00670
(AdoHcyase_NAD)
PF05221
(AdoHcyase)
4 GLN A  59
THR A  60
THR A 193
LEU A 378
K  A   2 ( 3.3A)
ADN  A 500 (-4.6A)
NAD  A 550 ( 3.0A)
NAD  A 550 (-4.3A)
0.49A 6f3mD-3n58A:
54.4
6f3mD-3n58A:
53.12
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.
3nyw PUTATIVE
OXIDOREDUCTASE


(Bacteroides
thetaiotaomicron)
PF00106
(adh_short)
4 ILE A 122
THR A  11
THR A 127
LEU A 166
None
1.06A 6f3mD-3nywA:
8.1
6f3mD-3nywA:
20.38
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3one ADENOSYLHOMOCYSTEINA
SE


(Lupinus luteus)
PF00670
(AdoHcyase_NAD)
PF05221
(AdoHcyase)
4 GLN A  66
THR A  67
THR A 206
LEU A 395
ADE  A 506 (-3.8A)
ADE  A 506 (-4.5A)
NAD  A 501 (-2.8A)
NAD  A 501 (-4.2A)
0.30A 6f3mD-3oneA:
51.7
6f3mD-3oneA:
47.80
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.
3pko GERANYLGERANYL
PYROPHOSPHATE
SYNTHASE


(Lactobacillus
brevis)
PF00348
(polyprenyl_synt)
4 ILE A 270
GLN A 228
THR A 227
LEU A 244
None
1.09A 6f3mD-3pkoA:
undetectable
6f3mD-3pkoA:
22.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3q9c ACETYLPOLYAMINE
AMIDOHYDROLASE


(Mycoplana
ramosa)
PF00850
(Hist_deacetyl)
4 ILE A 136
GLN A 179
THR A  58
LEU A 316
None
1.15A 6f3mD-3q9cA:
3.2
6f3mD-3q9cA:
22.31
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.
3s8i PROTEIN DDI1 HOMOLOG
1


(Homo sapiens)
PF09668
(Asp_protease)
4 ILE A 246
GLN A 357
THR A 358
LEU A 344
None
1.05A 6f3mD-3s8iA:
undetectable
6f3mD-3s8iA:
16.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3sfz APOPTOTIC PEPTIDASE
ACTIVATING FACTOR 1


(Mus musculus)
PF00400
(WD40)
PF00931
(NB-ARC)
PF12894
(ANAPC4_WD40)
4 ILE A1244
THR A 935
THR A 602
LEU A 922
None
0.99A 6f3mD-3sfzA:
undetectable
6f3mD-3sfzA:
17.36
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.
3vlb XYLOGLUCAN-SPECIFIC
ENDO-BETA-1,4-GLUCAN
ASE A


(Aspergillus
aculeatus)
PF01670
(Glyco_hydro_12)
4 ILE B  82
GLN B  78
THR B  77
THR B 183
None
1.06A 6f3mD-3vlbB:
undetectable
6f3mD-3vlbB:
18.67
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.
3vr5 V-TYPE SODIUM ATPASE
SUBUNIT D
V-TYPE SODIUM ATPASE
SUBUNIT G


(Enterococcus
hirae)
PF01813
(ATP-synt_D)
PF01990
(ATP-synt_F)
4 ILE G  54
GLN G  59
THR G  58
LEU H  87
None
1.00A 6f3mD-3vr5G:
undetectable
6f3mD-3vr5G:
19.17
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.
3woy CLIP-ASSOCIATING
PROTEIN 2


(Homo sapiens)
PF12348
(CLASP_N)
4 ILE A 178
THR A 181
THR A 159
LEU A  99
None
0.88A 6f3mD-3woyA:
undetectable
6f3mD-3woyA:
19.03
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.
3wq8 BETA-GLUCOSIDASE

(Pyrococcus
furiosus)
PF00232
(Glyco_hydro_1)
4 ILE A 262
THR A 371
THR A 204
LEU A 299
None
0.94A 6f3mD-3wq8A:
undetectable
6f3mD-3wq8A:
22.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3zyi LEUCINE-RICH
REPEAT-CONTAINING
PROTEIN 4


(Homo sapiens)
PF07679
(I-set)
PF13855
(LRR_8)
4 ILE A  73
THR A  77
THR A  94
LEU A 106
None
0.78A 6f3mD-3zyiA:
undetectable
6f3mD-3zyiA:
20.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3zyn LEUCINE-RICH
REPEAT-CONTAINING
PROTEIN 4B


(Mus musculus)
PF00560
(LRR_1)
PF13855
(LRR_8)
4 ILE A  86
THR A  90
THR A 107
LEU A 119
None
0.75A 6f3mD-3zynA:
undetectable
6f3mD-3zynA:
21.02
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.
3zyo LEUCINE-RICH
REPEAT-CONTAINING
PROTEIN 4B


(Mus musculus)
PF00560
(LRR_1)
PF07679
(I-set)
PF13855
(LRR_8)
4 ILE A  86
THR A  90
THR A 107
LEU A 119
None
0.92A 6f3mD-3zyoA:
undetectable
6f3mD-3zyoA:
20.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ac3 BIFUNCTIONAL PROTEIN
GLMU


(Streptococcus
pneumoniae)
PF00132
(Hexapep)
PF00483
(NTP_transferase)
PF14602
(Hexapep_2)
4 ILE A   6
GLN A  72
THR A  67
LEU A  33
None
1.13A 6f3mD-4ac3A:
undetectable
6f3mD-4ac3A:
23.38
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.
4bxw FACTOR XA

(Pseudonaja
textilis)
PF00089
(Trypsin)
PF14670
(FXa_inhibition)
4 ILE A 376
GLN A 184
THR A 199
THR A 368
None
1.08A 6f3mD-4bxwA:
undetectable
6f3mD-4bxwA:
21.02
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.
4c89 ESTERASE

(Lactobacillus
plantarum)
PF07859
(Abhydrolase_3)
4 ILE A 195
THR A 184
THR A 166
LEU A 133
None
1.13A 6f3mD-4c89A:
5.5
6f3mD-4c89A:
22.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4dcm RIBOSOMAL RNA LARGE
SUBUNIT
METHYLTRANSFERASE G


(Escherichia
coli)
PF05175
(MTS)
4 ILE A 147
THR A 151
THR A 165
LEU A  35
None
1.03A 6f3mD-4dcmA:
6.6
6f3mD-4dcmA:
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.
4ha4 BETA-GALACTOSIDASE

(Acidilobus
saccharovorans)
PF00232
(Glyco_hydro_1)
4 ILE A 263
THR A 384
THR A 205
LEU A 312
None
0.96A 6f3mD-4ha4A:
undetectable
6f3mD-4ha4A:
21.59
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.
4igl YENB

(Yersinia
entomophaga)
PF03534
(SpvB)
PF12255
(TcdB_toxin_midC)
PF12256
(TcdB_toxin_midN)
4 ILE A 278
GLN A 371
THR A 370
LEU A 337
None
1.13A 6f3mD-4iglA:
undetectable
6f3mD-4iglA:
14.86
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.
4j9t DESIGNED UNNATURAL
AMINO ACID DEPENDENT
METALLOPROTEIN


(Micromonospora
viridifaciens)
PF13088
(BNR_2)
4 ILE A 143
THR A  73
THR A 140
LEU A 221
None
1.15A 6f3mD-4j9tA:
undetectable
6f3mD-4j9tA:
20.13
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.
4jwy GLUTAMATE RECEPTOR
IONOTROPIC, NMDA 2D


(Rattus
norvegicus)
PF10613
(Lig_chan-Glu_bd)
4 ILE A 213
GLN A 194
THR A 168
LEU A 164
None
1.12A 6f3mD-4jwyA:
undetectable
6f3mD-4jwyA:
19.11
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.
4jz7 CARBAMATE KINASE

(Giardia
intestinalis)
PF00696
(AA_kinase)
4 ILE A 214
GLN A 116
THR A 117
LEU A  78
None
1.07A 6f3mD-4jz7A:
2.3
6f3mD-4jz7A:
21.92
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.
4k92 CLIP-ASSOCIATING
PROTEIN 1


(Homo sapiens)
PF12348
(CLASP_N)
4 ILE A 410
THR A 413
THR A 391
LEU A 331
None
0.93A 6f3mD-4k92A:
undetectable
6f3mD-4k92A:
19.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4le7 PYOCIN L1

(Pseudomonas
aeruginosa)
PF01453
(B_lectin)
4 ILE A 185
THR A 169
THR A 195
LEU A 213
None
1.10A 6f3mD-4le7A:
undetectable
6f3mD-4le7A:
18.44
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4lvc S-ADENOSYL-L-HOMOCYS
TEINE HYDROLASE
(SAHASE)


(Bradyrhizobium
elkanii)
PF00670
(AdoHcyase_NAD)
PF05221
(AdoHcyase)
4 GLN A  62
THR A  63
THR A 198
LEU A 383
NH4  A 502 ( 3.1A)
ADN  A 501 (-4.5A)
NAD  A 503 ( 2.9A)
NAD  A 503 ( 3.9A)
0.19A 6f3mD-4lvcA:
53.7
6f3mD-4lvcA:
53.09
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.
4m6w FANCONI ANEMIA GROUP
M PROTEIN
FANCONI
ANEMIA-ASSOCIATED
PROTEIN OF 24 KDA


(Homo sapiens)
PF02732
(ERCC4)
PF12826
(HHH_2)
4 ILE A1979
GLN B 165
THR B 162
THR A1986
None
1.07A 6f3mD-4m6wA:
2.7
6f3mD-4m6wA:
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.
4n6k TRAP DICARBOXYLATE
TRANSPORTER-DCTP
SUBUNIT


(Desulfovibrio
salexigens)
PF03480
(DctP)
5 ILE A 157
GLN A 159
THR A 229
THR A 235
LEU A 168
None
1.49A 6f3mD-4n6kA:
undetectable
6f3mD-4n6kA:
21.66
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.
4ni5 OXIDOREDUCTASE,
SHORT-CHAIN
DEHYDROGENASE/REDUCT
ASE FAMILY PROTEIN


(Brucella suis)
PF13561
(adh_short_C2)
4 ILE A 141
GLN A 246
THR A 244
LEU A 202
None
1.15A 6f3mD-4ni5A:
8.4
6f3mD-4ni5A:
22.75
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.
4ni5 OXIDOREDUCTASE,
SHORT-CHAIN
DEHYDROGENASE/REDUCT
ASE FAMILY PROTEIN


(Brucella suis)
PF13561
(adh_short_C2)
4 ILE A 141
GLN A 246
THR A 244
LEU A 211
None
0.97A 6f3mD-4ni5A:
8.4
6f3mD-4ni5A:
22.75
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.
4ntq CONTACT-DEPENDENT
INHIBITOR A
ECL CDII


(Enterobacter
cloacae)
PF15526
(Ntox21)
no annotation
4 ILE B  77
GLN A 181
THR B  74
LEU B  34
None
1.14A 6f3mD-4ntqB:
undetectable
6f3mD-4ntqB:
14.04
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.
4ofz TREHALOSE-PHOSPHATAS
E


(Brugia malayi)
no annotation 4 ILE A  99
GLN A  76
THR A  78
LEU A 141
None
1.02A 6f3mD-4ofzA:
5.0
6f3mD-4ofzA:
20.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4rgh PROTEIN DDI1 HOMOLOG
2


(Homo sapiens)
PF09668
(Asp_protease)
4 ILE A 206
GLN A 317
THR A 318
LEU A 304
None
1.03A 6f3mD-4rghA:
undetectable
6f3mD-4rghA:
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.
4u0p LIPOYL SYNTHASE 2

(Thermosynechococcus
elongatus)
PF04055
(Radical_SAM)
4 ILE B  89
THR B 122
THR B  35
LEU B  96
None
1.14A 6f3mD-4u0pB:
undetectable
6f3mD-4u0pB:
20.26
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.
4u0p LIPOYL SYNTHASE 2

(Thermosynechococcus
elongatus)
PF04055
(Radical_SAM)
4 ILE B  89
THR B 122
THR B  35
LEU B  98
None
0.97A 6f3mD-4u0pB:
undetectable
6f3mD-4u0pB:
20.26
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.
5cd2 ENDO-1,4-D-GLUCANASE

(Aliivibrio
fischeri)
PF01270
(Glyco_hydro_8)
4 ILE A  71
GLN A  77
THR A  73
THR A 120
None
None
GOL  A 402 ( 4.5A)
None
1.12A 6f3mD-5cd2A:
undetectable
6f3mD-5cd2A:
23.11
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.
5hev RESPONSE REGULATOR
PROTEIN VRAR


(Enterococcus
faecium)
PF00072
(Response_reg)
PF00196
(GerE)
4 ILE A  79
GLN A 119
THR A 118
LEU A   5
None
1.13A 6f3mD-5hevA:
2.0
6f3mD-5hevA:
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.
5ie2 OXALATE--COA LIGASE

(Arabidopsis
thaliana)
PF00501
(AMP-binding)
PF13193
(AMP-binding_C)
4 ILE A 395
GLN A 355
THR A 392
LEU A 404
None
1.14A 6f3mD-5ie2A:
4.2
6f3mD-5ie2A:
23.82
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.
5k8g ANTIFREEZE PROTEIN

(Marinomonas
primoryensis)
no annotation 4 ILE A 189
GLN A 118
THR A 140
LEU A 122
None
1.12A 6f3mD-5k8gA:
undetectable
6f3mD-5k8gA:
21.73
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.
5m59 PRE-MRNA SPLICING
HELICASE-LIKE
PROTEIN


(Chaetomium
thermophilum)
PF00270
(DEAD)
PF00271
(Helicase_C)
PF02889
(Sec63)
4 ILE A 773
THR A 756
THR A 781
LEU A 827
None
1.14A 6f3mD-5m59A:
undetectable
6f3mD-5m59A:
13.34
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.
5svc ACETONE CARBOXYLASE
ALPHA SUBUNIT


(Xanthobacter
autotrophicus)
PF02538
(Hydantoinase_B)
4 ILE A 238
THR A 156
THR A 211
LEU A 217
None
1.13A 6f3mD-5svcA:
undetectable
6f3mD-5svcA:
20.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ul4 OXSB PROTEIN

(Bacillus
megaterium)
PF02310
(B12-binding)
4 ILE A 345
GLN A 337
THR A 289
LEU A 385
None
EDO  A 811 (-4.5A)
None
None
1.06A 6f3mD-5ul4A:
3.5
6f3mD-5ul4A:
19.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5xil PUTATIVE PROLYL-TRNA
SYNTHETASE


(Leishmania
major)
no annotation 4 ILE A 543
GLN A 541
THR A 540
LEU A 568
None
1.09A 6f3mD-5xilA:
undetectable
6f3mD-5xilA:
10.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5z73 ALR0819 PROTEIN

(Nostoc sp. PCC
7120)
no annotation 4 ILE A 271
GLN A 241
THR A 303
LEU A 250
None
0.92A 6f3mD-5z73A:
undetectable
6f3mD-5z73A:
10.39
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6aph ADENOSYLHOMOCYSTEINA
SE


(Elizabethkingia
anophelis)
PF00670
(AdoHcyase_NAD)
PF05221
(AdoHcyase)
4 GLN A  62
THR A  63
THR A 162
LEU A 349
ADN  A 501 (-3.8A)
ADN  A 501 (-4.5A)
NAD  A 500 ( 2.9A)
NAD  A 500 ( 4.3A)
0.61A 6f3mD-6aphA:
58.3
6f3mD-6aphA:
56.25
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.
6brd RIFAMPIN
MONOOXYGENASE


(Streptomyces
venezuelae)
no annotation 4 ILE A 369
GLN A 288
THR A 373
THR A  80
None
0.87A 6f3mD-6brdA:
3.4
6f3mD-6brdA:
10.34
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.
6c93 CYTOCHROME P450 4B1

(Oryctolagus
cuniculus)
no annotation 4 ILE A 449
THR A 137
THR A 306
LEU A 124
HEM  A 600 ( 4.3A)
None
HEM  A 600 ( 4.9A)
None
1.11A 6f3mD-6c93A:
undetectable
6f3mD-6c93A:
12.07
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.
6cv0 SPIKE GLYCOPROTEIN

(Avian
coronavirus)
no annotation 4 ILE A 933
GLN A 600
THR A 601
LEU A 697
None
0.98A 6f3mD-6cv0A:
undetectable
6f3mD-6cv0A:
10.75
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.
6g2j NADH-UBIQUINONE
OXIDOREDUCTASE CHAIN
4


(Mus musculus)
no annotation 4 ILE M 178
GLN M 168
THR M 173
THR M 183
None
1.02A 6f3mD-6g2jM:
undetectable
6f3mD-6g2jM:
11.61
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.
6gbn -

(-)
no annotation 4 GLN A  60
THR A  61
THR A 160
LEU A 347
NA  A 503 ( 3.2A)
ADN  A 501 (-4.6A)
NAD  A 502 ( 2.8A)
NAD  A 502 (-3.9A)
0.19A 6f3mD-6gbnA:
57.5
6f3mD-6gbnA:
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.
6gmb HYDROXYACID OXIDASE
1


(Homo sapiens)
no annotation 4 GLN A 350
THR A  60
THR A  64
LEU A 304
None
1.04A 6f3mD-6gmbA:
undetectable
6f3mD-6gmbA:
11.34