SIMILAR PATTERNS OF AMINO ACIDS FOR 4L39_A_SALA602_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.
1bkh MUCONATE LACTONIZING
ENZYME


(Pseudomonas
putida)
PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C)
4 LEU A 360
ILE A 352
THR A 355
GLY A 357
None
1.01A 4l39A-1bkhA:
1.2
4l39A-1bkhA:
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.
1e2z CYTOCHROME F

(Chlamydomonas
reinhardtii)
PF01333
(Apocytochr_F_C)
PF16639
(Apocytochr_F_N)
4 LEU A 100
TYR A 102
ILE A  49
GLY A  72
None
None
None
HEC  A 900 (-3.9A)
1.02A 4l39A-1e2zA:
undetectable
4l39A-1e2zA:
17.81
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.
1gzk RAC-BETA
SERINE/THREONINE
PROTEIN KINASE


(Homo sapiens)
PF00069
(Pkinase)
PF00433
(Pkinase_C)
4 LEU A 158
TYR A 231
THR A 292
GLY A 295
None
1.01A 4l39A-1gzkA:
0.0
4l39A-1gzkA:
22.02
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.
1j3e SEQA PROTEIN

(Escherichia
coli)
PF03925
(SeqA)
4 LEU A  11
TYR A  16
ILE A  95
THR A  32
None
1.03A 4l39A-1j3eA:
undetectable
4l39A-1j3eA:
11.84
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.
1jsd HAEMAGGLUTININ (HA1
CHAIN)


(Influenza A
virus)
PF00509
(Hemagglutinin)
4 LEU A 184
TYR A 185
ILE A 242
GLY A 128
None
0.89A 4l39A-1jsdA:
0.0
4l39A-1jsdA:
20.28
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.
1lrr SEQA PROTEIN

(Escherichia
coli)
PF03925
(SeqA)
4 LEU A  76
TYR A  81
ILE A 160
THR A  97
None
1.00A 4l39A-1lrrA:
undetectable
4l39A-1lrrA:
12.86
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.
1oi1 SCML2 PROTEIN

(Homo sapiens)
PF02820
(MBT)
4 LEU A 109
ILE A 189
THR A 233
GLY A  90
None
0.90A 4l39A-1oi1A:
undetectable
4l39A-1oi1A:
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.
1q90 APOCYTOCHROME F

(Chlamydomonas
reinhardtii)
PF01333
(Apocytochr_F_C)
PF16639
(Apocytochr_F_N)
4 LEU A 100
TYR A 102
ILE A  49
GLY A  72
None
None
None
HEM  A 900 (-3.9A)
0.93A 4l39A-1q90A:
undetectable
4l39A-1q90A:
19.07
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.
1qle CCYTOCHROME C
OXIDASE
CYTOCHROME C OXIDASE
POLYPEPTIDE III


(Paracoccus
denitrificans)
PF00510
(COX3)
PF07835
(COX4_pro_2)
4 TYR C   8
ILE D  16
THR C  79
GLY D  12
None
1.03A 4l39A-1qleC:
0.0
4l39A-1qleC:
16.81
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.
1rty YVQK PROTEIN

(Bacillus
subtilis)
PF01923
(Cob_adeno_trans)
4 LEU A  93
TYR A 152
ILE A  40
THR A 129
None
0.95A 4l39A-1rtyA:
undetectable
4l39A-1rtyA:
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.
1ti8 HEMAGGLUTININ

(Influenza A
virus)
PF00509
(Hemagglutinin)
4 LEU A 194
TYR A 195
ILE A 252
GLY A 134
None
0.96A 4l39A-1ti8A:
undetectable
4l39A-1ti8A:
19.73
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.
1v19 2-KETO-3-DEOXYGLUCON
ATE KINASE


(Thermus
thermophilus)
PF00294
(PfkB)
4 TYR A 103
ARG A 105
ILE A 134
GLY A  33
None
0.96A 4l39A-1v19A:
1.1
4l39A-1v19A:
17.96
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.
1v19 2-KETO-3-DEOXYGLUCON
ATE KINASE


(Thermus
thermophilus)
PF00294
(PfkB)
4 TYR A 103
ARG A 105
ILE A 134
GLY A  34
None
0.91A 4l39A-1v19A:
1.1
4l39A-1v19A:
17.96
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.
1v29 NITRILE HYDRATASE B
CHAIN


(Bacillus
smithii)
PF02211
(NHase_beta)
4 LEU B 206
ILE B 217
THR B 150
GLY B 170
None
0.98A 4l39A-1v29B:
undetectable
4l39A-1v29B:
16.78
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.
1v76 RNASE P PROTEIN
PH1771P


(Pyrococcus
horikoshii)
PF01868
(UPF0086)
4 LEU A  78
ARG A 119
ILE A  43
GLY A 109
None
0.94A 4l39A-1v76A:
undetectable
4l39A-1v76A:
9.86
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.
1xaj 3-DEHYDROQUINATE
SYNTHASE


(Staphylococcus
aureus)
PF01761
(DHQ_synthase)
4 LEU A 184
TYR A 180
ILE A 265
GLY A 241
None
0.83A 4l39A-1xajA:
undetectable
4l39A-1xajA:
19.42
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.
1zbm HYPOTHETICAL PROTEIN
AF1704


(Archaeoglobus
fulgidus)
PF02621
(VitK2_biosynth)
4 LEU A 248
TYR A 252
THR A 105
GLY A 175
None
0.94A 4l39A-1zbmA:
undetectable
4l39A-1zbmA:
20.07
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.
2b3d MODULATOR OF DRUG
ACTIVITY B


(Escherichia
coli)
PF02525
(Flavodoxin_2)
4 LEU A 199
TYR A 195
ILE A  17
GLY A  41
None
0.85A 4l39A-2b3dA:
undetectable
4l39A-2b3dA:
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.
2d4w GLYCEROL KINASE

(Cellulomonas
sp.)
PF00370
(FGGY_N)
PF02782
(FGGY_C)
4 LEU A 216
ILE A 205
THR A 191
GLY A 137
None
1.04A 4l39A-2d4wA:
undetectable
4l39A-2d4wA:
23.20
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.
2g02 NISIN BIOSYNTHESIS
PROTEIN NISC


(Lactococcus
lactis)
PF05147
(LANC_like)
4 LEU A  39
TYR A  88
ILE A 329
GLY A 377
None
0.68A 4l39A-2g02A:
undetectable
4l39A-2g02A:
22.47
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.
2lsu TPR
REPEAT-CONTAINING
PROTEIN ASSOCIATED
WITH HSP90


(Saccharomyces
cerevisiae)
PF14559
(TPR_19)
4 TYR A  82
ARG A  83
ILE A  96
GLY A  89
None
0.88A 4l39A-2lsuA:
undetectable
4l39A-2lsuA:
12.81
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.
2p0k POLYCOMB PROTEIN
SCMH1


(Homo sapiens)
PF02820
(MBT)
4 LEU A 104
ILE A 184
THR A 228
GLY A  85
None
0.83A 4l39A-2p0kA:
undetectable
4l39A-2p0kA:
16.87
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.
2qzp ACYLAMINO-ACID-RELEA
SING ENZYME


(Aeropyrum
pernix)
PF00326
(Peptidase_S9)
4 LEU A 518
ILE A 512
THR A 451
GLY A 465
None
1.03A 4l39A-2qzpA:
undetectable
4l39A-2qzpA:
23.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2v73 PUTATIVE
EXO-ALPHA-SIALIDASE


(Clostridium
perfringens)
PF02973
(Sialidase)
4 LEU A 108
TYR A  78
ILE A 133
GLY A  38
None
1.02A 4l39A-2v73A:
undetectable
4l39A-2v73A:
16.12
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.
2vsk HEMAGGLUTININ-NEURAM
INIDASE


(Hendra
henipavirus)
PF00423
(HN)
4 LEU A 198
TYR A 547
ILE A 514
GLY A 523
None
0.89A 4l39A-2vskA:
undetectable
4l39A-2vskA:
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.
2vsm HEMAGGLUTININ-NEURAM
INIDASE


(Nipah
henipavirus)
PF00423
(HN)
4 LEU A 198
TYR A 547
ILE A 514
GLY A 523
None
1.00A 4l39A-2vsmA:
undetectable
4l39A-2vsmA:
20.85
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.
2vwb PUTATIVE
O-SIALOGLYCOPROTEIN
ENDOPEPTIDASE


(Methanocaldococcus
jannaschii)
PF00814
(Peptidase_M22)
PF01163
(RIO1)
4 ARG A  91
ILE A 310
THR A 308
GLY A 103
None
1.01A 4l39A-2vwbA:
undetectable
4l39A-2vwbA:
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.
2wrd HEMAGGLUTININ

(Influenza A
virus)
PF00509
(Hemagglutinin)
4 LEU A 193
TYR A 194
ILE A 251
GLY A 133
None
0.88A 4l39A-2wrdA:
undetectable
4l39A-2wrdA:
23.00
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.
2y4f PEROXIDASE YCDB

(Escherichia
coli)
PF04261
(Dyp_perox)
4 TYR A 317
ARG A 175
ILE A 363
GLY A 365
None
SO4  A 400 (-3.9A)
None
None
0.97A 4l39A-2y4fA:
undetectable
4l39A-2y4fA:
22.17
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.
2yp2 HEMAGGLUTININ

(Influenza A
virus)
PF00509
(Hemagglutinin)
4 LEU A 194
TYR A 195
ILE A 252
GLY A 134
None
0.82A 4l39A-2yp2A:
undetectable
4l39A-2yp2A:
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.
2zae RIBONUCLEASE P
PROTEIN COMPONENT 1


(Pyrococcus
horikoshii)
PF01868
(UPF0086)
4 LEU A  78
ARG A 119
ILE A  43
GLY A 109
None
0.93A 4l39A-2zaeA:
undetectable
4l39A-2zaeA:
11.23
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.
3bs8 GLUTAMATE-1-SEMIALDE
HYDE 2,1-AMINOMUTASE


(Bacillus
subtilis)
PF00202
(Aminotran_3)
4 LEU A 394
TYR A 383
ILE A 337
GLY A 358
None
0.96A 4l39A-3bs8A:
0.9
4l39A-3bs8A:
24.25
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.
3cr3 PTS-DEPENDENT
DIHYDROXYACETONE
KINASE, ADP-BINDING
SUBUNIT DHAL
PTS-DEPENDENT
DIHYDROXYACETONE
KINASE,
PHOSPHOTRANSFERASE
SUBUNIT DHAM


(Lactococcus
lactis)
PF02734
(Dak2)
PF03610
(EIIA-man)
4 LEU C  67
ILE C  42
THR C  44
GLY A  77
None
None
None
ADP  A1211 (-3.3A)
0.86A 4l39A-3cr3C:
undetectable
4l39A-3cr3C:
13.17
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.
3cz8 PUTATIVE
SPORULATION-SPECIFIC
GLYCOSYLASE YDHD


(Bacillus
subtilis)
PF00704
(Glyco_hydro_18)
4 LEU A 198
TYR A 133
ILE A 151
GLY A 206
None
1.00A 4l39A-3cz8A:
1.9
4l39A-3cz8A:
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.
3d6k PUTATIVE
AMINOTRANSFERASE


(Corynebacterium
diphtheriae)
PF12897
(Aminotran_MocR)
4 LEU A  50
ILE A  78
THR A 253
GLY A 262
None
0.96A 4l39A-3d6kA:
undetectable
4l39A-3d6kA:
20.64
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.
3e0x LIPASE-ESTERASE
RELATED PROTEIN


(Clostridium
acetobutylicum)
PF12146
(Hydrolase_4)
4 LEU A 227
TYR A  88
ILE A 143
GLY A 222
None
OXE  A 243 (-4.2A)
None
None
0.94A 4l39A-3e0xA:
undetectable
4l39A-3e0xA:
19.18
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.
3eyk HEMAGGLUTININ HA1
CHAIN


(Influenza A
virus)
PF00509
(Hemagglutinin)
4 LEU A 196
TYR A 197
ILE A 254
GLY A 134
None
0.96A 4l39A-3eykA:
undetectable
4l39A-3eykA:
21.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3g3o VACUOLAR TRANSPORTER
CHAPERONE 2


(Saccharomyces
cerevisiae)
PF09359
(VTC)
4 LEU A 530
TYR A 531
ILE A 439
GLY A 464
None
1.00A 4l39A-3g3oA:
undetectable
4l39A-3g3oA:
23.10
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.
3gde DNA LIGASE

(Archaeoglobus
fulgidus)
PF01068
(DNA_ligase_A_M)
PF04675
(DNA_ligase_A_N)
PF04679
(DNA_ligase_A_C)
4 LEU A  70
TYR A 144
ILE A 159
GLY A  64
None
0.87A 4l39A-3gdeA:
undetectable
4l39A-3gdeA:
22.64
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.
3lhi PUTATIVE
6-PHOSPHOGLUCONOLACT
ONASE


(Neisseria
gonorrhoeae)
PF01182
(Glucosamine_iso)
4 LEU A 218
ILE A 192
THR A 140
GLY A 138
None
0.84A 4l39A-3lhiA:
undetectable
4l39A-3lhiA:
16.32
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.
3lwd 6-PHOSPHOGLUCONOLACT
ONASE


(Chromohalobacter
salexigens)
PF01182
(Glucosamine_iso)
4 LEU A 215
ILE A 188
THR A 138
GLY A 136
None
0.78A 4l39A-3lwdA:
undetectable
4l39A-3lwdA:
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.
3mwt NUCLEOPROTEIN

(Lassa
mammarenavirus)
PF00843
(Arena_nucleocap)
PF17290
(Arena_ncap_C)
4 LEU A 312
TYR A 308
ARG A 300
GLY A 177
None
1.04A 4l39A-3mwtA:
undetectable
4l39A-3mwtA:
23.02
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.
3o59 DNA POLYMERASE II
LARGE SUBUNIT


(Pyrococcus
horikoshii)
PF03833
(PolC_DP2)
4 LEU X 250
TYR X 194
THR X 226
GLY X 148
None
0.91A 4l39A-3o59X:
2.1
4l39A-3o59X:
20.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3oaj PUTATIVE
RING-CLEAVING
DIOXYGENASE MHQO


(Bacillus
subtilis)
PF00903
(Glyoxalase)
4 LEU A 127
TYR A  85
ILE A  12
GLY A  81
None
1.00A 4l39A-3oajA:
undetectable
4l39A-3oajA:
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.
3ono RIBOSE/GALACTOSE
ISOMERASE


(Vibrio
parahaemolyticus)
PF02502
(LacAB_rpiB)
PF12408
(DUF3666)
4 LEU A 209
TYR A 205
ILE A  53
GLY A 185
None
0.97A 4l39A-3onoA:
undetectable
4l39A-3onoA:
16.99
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.
3q4d POSSIBLE
CHLOROMUCONATE
CYCLOISOMERASE
MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY


(Cytophaga
hutchinsonii)
PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C)
4 LEU A 323
ILE A 334
THR A 132
GLY A 340
None
0.98A 4l39A-3q4dA:
2.6
4l39A-3q4dA:
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.
3q4d POSSIBLE
CHLOROMUCONATE
CYCLOISOMERASE
MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY


(Cytophaga
hutchinsonii)
PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C)
4 LEU A 359
TYR A   9
ILE A  43
GLY A 353
None
0.98A 4l39A-3q4dA:
2.6
4l39A-3q4dA:
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.
3qqi HEMAGGLUTININ

(Influenza A
virus)
PF00509
(Hemagglutinin)
4 LEU A 194
TYR A 195
ILE A 252
GLY A 134
None
None
None
EPE  A3380 (-3.4A)
0.82A 4l39A-3qqiA:
undetectable
4l39A-3qqiA:
16.92
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.
3r5t FERRIC VIBRIOBACTIN
ABC TRANSPORTER,
PERIPLASMIC FERRIC
VIBRIOBACTIN-BINDING
PROTEIN


(Vibrio cholerae)
PF01497
(Peripla_BP_2)
4 LEU A  65
ILE A 142
THR A 162
GLY A 159
None
0.93A 4l39A-3r5tA:
undetectable
4l39A-3r5tA:
16.92
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.
3rko NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT M


(Escherichia
coli)
no annotation 4 LEU M 211
TYR M 207
ILE M 496
GLY M  59
None
0.86A 4l39A-3rkoM:
1.0
4l39A-3rkoM:
21.82
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.
3u4g NAMN:DMB
PHOSPHORIBOSYLTRANSF
ERASE


(Pyrococcus
horikoshii)
no annotation 4 LEU A 125
ILE A 138
THR A 210
GLY A 213
None
0.94A 4l39A-3u4gA:
1.6
4l39A-3u4gA:
21.15
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.
3u4j NAD-DEPENDENT
ALDEHYDE
DEHYDROGENASE


(Sinorhizobium
meliloti)
PF00171
(Aldedh)
4 LEU A 128
ARG A 179
ILE A 466
GLY A 479
None
0.96A 4l39A-3u4jA:
undetectable
4l39A-3u4jA:
22.48
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.
4a22 FRUCTOSE-BISPHOSPHAT
E ALDOLASE


(Mycobacterium
tuberculosis)
PF01116
(F_bP_aldolase)
4 LEU A 204
ILE A 137
THR A 182
GLY A 163
None
1.00A 4l39A-4a22A:
1.6
4l39A-4a22A:
21.48
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.
4a2b CELL DIVISION
PROTEIN FTSA,
PUTATIVE


(Thermotoga
maritima)
PF02491
(SHS2_FTSA)
PF14450
(FtsA)
4 LEU A  64
ILE A  81
THR A  11
GLY A  22
None
0.72A 4l39A-4a2bA:
undetectable
4l39A-4a2bA:
23.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4c13 UDP-N-ACETYLMURAMOYL
-L-ALANYL-D-GLUTAMAT
E--L-LYSINE LIGASE


(Staphylococcus
aureus)
PF01225
(Mur_ligase)
PF02875
(Mur_ligase_C)
PF08245
(Mur_ligase_M)
4 TYR A 351
ARG A 335
THR A 115
GLY A 136
UML  A 598 ( 4.3A)
PO4  A 601 (-3.9A)
MG  A 503 ( 3.7A)
None
1.02A 4l39A-4c13A:
undetectable
4l39A-4c13A:
22.41
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.
4fdg MINICHROMOSOME
MAINTENANCE PROTEIN
MCM


(Sulfolobus
solfataricus)
no annotation 4 LEU B 373
ILE B 406
THR B 363
GLY B 367
None
1.02A 4l39A-4fdgB:
undetectable
4l39A-4fdgB:
22.74
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.
4hfu HEMAGGLUTININ HA1

(Influenza A
virus)
PF00509
(Hemagglutinin)
4 LEU A 194
TYR A 195
ILE A 252
GLY A 134
None
0.96A 4l39A-4hfuA:
undetectable
4l39A-4hfuA:
20.54
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.
4hkx HEMAGGLUTININ HA1

(Influenza A
virus)
PF00509
(Hemagglutinin)
4 LEU E 194
TYR E 195
ILE E 252
GLY E 134
None
0.84A 4l39A-4hkxE:
undetectable
4l39A-4hkxE:
16.78
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.
4jcp PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE


(Brugia malayi)
PF00160
(Pro_isomerase)
4 LEU A  69
ILE A  12
THR A 159
GLY A 153
None
1.04A 4l39A-4jcpA:
undetectable
4l39A-4jcpA:
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.
4jhi MTN13 PROTEIN

(Medicago
truncatula)
PF00407
(Bet_v_1)
4 LEU A  90
TYR A 133
ILE A  98
GLY A  87
None
EMU  A 202 ( 4.3A)
EMU  A 202 ( 4.9A)
None
0.90A 4l39A-4jhiA:
undetectable
4l39A-4jhiA:
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.
4jug HEMAGGLUTININ

(Influenza A
virus)
PF00509
(Hemagglutinin)
4 LEU A 194
TYR A 195
ILE A 252
GLY A 134
None
0.96A 4l39A-4jugA:
undetectable
4l39A-4jugA:
20.69
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.
4kw5 OXIDOREDUCTASE

(Mycobacterium
tuberculosis)
PF01565
(FAD_binding_4)
PF04030
(ALO)
4 LEU A 161
ARG A 159
THR A 153
GLY A 182
None
1.02A 4l39A-4kw5A:
undetectable
4l39A-4kw5A:
22.95
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.
4kwm HEMAGGLUTININ

(Influenza A
virus)
PF00509
(Hemagglutinin)
4 LEU A 190
TYR A 191
ILE A 248
GLY A 130
None
1.03A 4l39A-4kwmA:
undetectable
4l39A-4kwmA:
19.42
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.
4mea PREDICTED PROTEIN

(Acinetobacter
nosocomialis)
PF00561
(Abhydrolase_1)
4 LEU A 167
TYR A 154
ILE A 114
GLY A 141
None
0.88A 4l39A-4meaA:
undetectable
4l39A-4meaA:
19.08
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.
4o87 N-TAGGED NUCLEASE

(Millerozyma
acaciae)
no annotation 4 LEU A 200
ILE A 268
THR A 183
GLY A 180
None
0.76A 4l39A-4o87A:
undetectable
4l39A-4o87A:
20.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4oul CAPRIN-2

(Homo sapiens)
PF00386
(C1q)
4 LEU A1123
TYR A1045
THR A1029
GLY A1027
None
0.92A 4l39A-4oulA:
undetectable
4l39A-4oulA:
12.52
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.
4ovm UNCHARACTERIZED
PROTEIN SGCJ


(Streptomyces
carzinostaticus)
PF14534
(DUF4440)
4 TYR A 136
ILE A 118
THR A 100
GLY A  83
None
0.72A 4l39A-4ovmA:
undetectable
4l39A-4ovmA:
13.15
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.
4r6k SOLUTE-BINDING
PROTEIN


(Bacillus
subtilis)
PF13416
(SBP_bac_8)
4 LEU A 283
ILE A 105
THR A 123
GLY A 125
None
1.02A 4l39A-4r6kA:
undetectable
4l39A-4r6kA:
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.
4uwm 3,6-DIKETOCAMPHANE
1,6 MONOOXYGENASE


(Pseudomonas
putida)
PF00296
(Bac_luciferase)
4 LEU A 285
TYR A  12
ILE A 223
THR A 258
None
PGE  A 404 (-4.5A)
FMN  A 400 ( 4.5A)
PGE  A 404 (-3.2A)
0.97A 4l39A-4uwmA:
0.6
4l39A-4uwmA:
20.52
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.
4we6 HEMAGGLUTININ HA1
CHAIN


(Influenza A
virus)
PF00509
(Hemagglutinin)
4 LEU A 154
TYR A 155
ILE A 212
GLY A  94
None
None
None
GOL  A 303 (-3.4A)
0.85A 4l39A-4we6A:
undetectable
4l39A-4we6A:
20.10
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.
4xb6 ALPHA-D-RIBOSE
1-METHYLPHOSPHONATE
5-TRIPHOSPHATE
SYNTHASE SUBUNIT
PHNI


(Escherichia
coli)
PF05861
(PhnI)
4 TYR C 124
ILE C 105
THR C 121
GLY C 119
None
1.00A 4l39A-4xb6C:
undetectable
4l39A-4xb6C:
20.07
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.
4yys FICIN ISOFORM B

(Ficus carica)
PF00112
(Peptidase_C1)
4 LEU A  48
ILE A 110
THR A  38
GLY A  36
None
1.03A 4l39A-4yysA:
undetectable
4l39A-4yysA:
16.90
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.
4zcf RESTRICTION
ENDONUCLEASE
ECOP15I, RESTRICTION
SUBUNIT


(Escherichia
coli)
PF04851
(ResIII)
4 LEU C 267
TYR C 265
THR C  93
GLY C  89
None
None
None
AMP  C1001 (-3.4A)
0.97A 4l39A-4zcfC:
undetectable
4l39A-4zcfC:
20.35
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.
5b4x REELIN

(Mus musculus)
PF07974
(EGF_2)
4 LEU A2014
ILE A2022
THR A2020
GLY A2130
None
0.82A 4l39A-5b4xA:
undetectable
4l39A-5b4xA:
21.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5c9e SEPL

(Escherichia
coli)
PF07201
(HrpJ)
4 LEU A 167
ILE A 100
THR A  95
GLY A 172
None
0.76A 4l39A-5c9eA:
1.6
4l39A-5c9eA:
19.18
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.
5gj4 SERINE PROTEASE NS3

(Zika virus)
PF00949
(Peptidase_S7)
4 LEU B  58
TYR B  79
THR B  48
GLY B  37
None
1.03A 4l39A-5gj4B:
undetectable
4l39A-5gj4B:
15.85
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.
5gnm VITAMIN D(3)
25-HYDROXYLASE


(Pseudonocardia
autotrophica)
PF00067
(p450)
4 LEU A 391
TYR A 382
ARG A 389
GLY A 248
None
0.70A 4l39A-5gnmA:
undetectable
4l39A-5gnmA:
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.
5hc8 PRENYLTRANSFERENCE
FOR PROTEIN


(Lavandula
lanata)
PF01255
(Prenyltransf)
4 LEU A 135
TYR A 139
ILE A  75
GLY A  92
61G  A 403 ( 4.5A)
None
None
None
0.94A 4l39A-5hc8A:
undetectable
4l39A-5hc8A:
18.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5huq LACTATE RACEMIZATION
OPERON PROTEIN LARA


(Lactobacillus
plantarum)
PF09861
(DUF2088)
4 LEU A 147
ILE A 155
THR A 230
GLY A 145
None
0.99A 4l39A-5huqA:
undetectable
4l39A-5huqA:
22.07
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.
5i2g DIOL DEHYDRATASE

(Roseburia
inulinivorans)
PF01228
(Gly_radical)
PF02901
(PFL-like)
4 TYR A  23
ILE A 812
THR A 824
GLY A 340
None
0.92A 4l39A-5i2gA:
undetectable
4l39A-5i2gA:
21.03
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.
5k82 APOLIPOPROTEIN B
MRNA EDITING ENZYME,
CATALYTIC
PEPTIDE-LIKE
3G,APOLIPOPROTEIN B
MRNA EDITING ENZYME,
CATALYTIC
PEPTIDE-LIKE 3G


(Macaca mulatta)
PF08210
(APOBEC_N)
4 LEU A 135
ILE A 151
THR A 188
GLY A 190
None
0.99A 4l39A-5k82A:
undetectable
4l39A-5k82A:
15.83
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.
5kan HEMAGGLUTININ HA1

(Influenza A
virus)
PF00509
(Hemagglutinin)
4 LEU A 194
TYR A 195
ILE A 252
GLY A 134
None
0.92A 4l39A-5kanA:
undetectable
4l39A-5kanA:
20.24
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.
5kia L-THREONINE
3-DEHYDROGENASE


(Burkholderia
thailandensis)
PF00107
(ADH_zinc_N)
PF08240
(ADH_N)
4 LEU A   4
ILE A  37
THR A  35
GLY A  62
None
0.94A 4l39A-5kiaA:
undetectable
4l39A-5kiaA:
21.20
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.
5l46 DIMETHYLGLYCINE
DEHYDROGENASE,
MITOCHONDRIAL


(Homo sapiens)
PF01266
(DAO)
PF01571
(GCV_T)
PF08669
(GCV_T_C)
PF16350
(FAO_M)
4 LEU A 198
TYR A 116
THR A  96
GLY A  94
None
None
None
FAD  A 901 ( 4.4A)
0.91A 4l39A-5l46A:
undetectable
4l39A-5l46A:
21.47
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.
5lc5 NADH DEHYDROGENASE
[UBIQUINONE]
IRON-SULFUR PROTEIN
3, MITOCHONDRIAL


(Bos taurus)
PF00329
(Complex1_30kDa)
4 LEU C  61
TYR C  94
ILE C 117
GLY C  56
None
0.71A 4l39A-5lc5C:
undetectable
4l39A-5lc5C:
17.35
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.
5m3q EUKARYOTIC
TRANSLATION
INITIATION FACTOR 6


(Chaetomium
thermophilum)
PF01912
(eIF-6)
4 LEU A  25
ILE A  92
THR A  20
GLY A  65
None
0.93A 4l39A-5m3qA:
undetectable
4l39A-5m3qA:
17.92
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.
5tg8 HEMAGGLUTININ HA1
CHAIN


(Influenza A
virus)
PF00509
(Hemagglutinin)
4 LEU A 194
TYR A 195
ILE A 252
GLY A 134
None
0.94A 4l39A-5tg8A:
undetectable
4l39A-5tg8A:
19.73
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.
5tr7 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE


(Vibrio cholerae)
PF00768
(Peptidase_S11)
PF07943
(PBP5_C)
4 LEU A 191
TYR A 202
ILE A 125
GLY A  77
None
1.00A 4l39A-5tr7A:
undetectable
4l39A-5tr7A:
20.52
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.
5umn HEMAGGLUTININ

(Influenza A
virus)
PF00509
(Hemagglutinin)
4 LEU A 194
TYR A 195
ILE A 252
GLY A 134
None
0.98A 4l39A-5umnA:
undetectable
4l39A-5umnA:
18.01
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.
5w6t HEMAGGLUTININ

(Influenza A
virus)
PF00509
(Hemagglutinin)
4 LEU A 194
TYR A 195
ILE A 252
GLY A 134
None
0.91A 4l39A-5w6tA:
undetectable
4l39A-5w6tA:
18.76
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.
5xgw ISOASPARTYL
DIPEPTIDASE


(Colwellia
psychrerythraea)
no annotation 4 LEU A 339
ILE A 372
THR A  64
GLY A  66
None
0.99A 4l39A-5xgwA:
0.8
4l39A-5xgwA:
9.26
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.
5xl2 HEMAGGLUTININ

(Influenza A
virus)
PF00509
(Hemagglutinin)
4 LEU A 191
TYR A 192
ILE A 249
GLY A 130
None
0.97A 4l39A-5xl2A:
undetectable
4l39A-5xl2A:
23.19
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.
5xl6 HEMAGGLUTININ

(Influenza A
virus)
PF00509
(Hemagglutinin)
4 LEU A 191
TYR A 192
ILE A 249
GLY A 130
SIA  A 603 (-4.7A)
None
None
SIA  A 603 ( 4.4A)
0.91A 4l39A-5xl6A:
undetectable
4l39A-5xl6A:
20.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5xrt -

(-)
no annotation 4 LEU A 194
TYR A 195
ILE A 252
GLY A 134
None
0.92A 4l39A-5xrtA:
undetectable
4l39A-5xrtA:
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.
5xyi 40S RIBOSOMAL
PROTEIN S21


(Trichomonas
vaginalis)
PF01249
(Ribosomal_S21e)
4 LEU V  61
TYR V  57
ARG V  22
THR V  20
U  2 890 ( 4.3A)
None
None
None
0.87A 4l39A-5xyiV:
undetectable
4l39A-5xyiV:
9.59
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.
6b8s DIHYDROOROTATE
DEHYDROGENASE
(QUINONE)


(Helicobacter
pylori)
no annotation 4 LEU A  76
TYR A 138
ILE A 171
GLY A 143
None
1.03A 4l39A-6b8sA:
1.2
4l39A-6b8sA:
8.65
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.
6bkp HEMAGGLUTININ

(Influenza A
virus)
no annotation 4 LEU A 194
TYR A 195
ILE A 252
GLY A 134
None
0.85A 4l39A-6bkpA:
undetectable
4l39A-6bkpA:
11.01
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.
6d8w HEMAGGLUTININ

(Influenza A
virus)
no annotation 4 LEU A 193
TYR A 194
ILE A 251
GLY A 133
OXM  A 502 (-4.9A)
None
None
None
0.93A 4l39A-6d8wA:
undetectable
4l39A-6d8wA:
8.09
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.
6f34 AMINO ACID
TRANSPORTER


(Geobacillus
kaustophilus)
no annotation 4 LEU A 112
TYR A 116
ILE A 234
GLY A 382
None
ARG  A 501 (-3.9A)
ARG  A 501 (-3.7A)
None
0.99A 4l39A-6f34A:
undetectable
4l39A-6f34A:
9.52