SIMILAR PATTERNS OF AMINO ACIDS FOR 4AE1_A_NCAA1536

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.
1aip ELONGATION FACTOR TS

(Thermus
thermophilus)
PF00889
(EF_TS)
4 GLY C 145
TYR C 150
ALA C 143
GLU C 121
None
0.98A 4ae1A-1aipC:
undetectable
4ae1A-1aipC:
16.27
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.
1ap2 MONOCLONAL ANTIBODY
C219


(Mus musculus)
PF07686
(V-set)
4 GLY A 105
TYR A  92
ALA A 106
TYR A  93
None
1.00A 4ae1A-1ap2A:
3.4
4ae1A-1ap2A:
11.65
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.
1dab P.69 PERTACTIN

(Bordetella
pertussis)
PF03212
(Pertactin)
4 GLY A 337
TYR A 342
ALA A 304
GLU A 311
None
0.99A 4ae1A-1dabA:
undetectable
4ae1A-1dabA:
24.25
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1dtp DIPHTHERIA TOXIN

(Corynephage
beta)
PF02763
(Diphtheria_C)
6 HIS A  21
GLY A  22
TYR A  54
ALA A  62
TYR A  65
GLU A 148
APU  A 200 ( 3.3A)
APU  A 200 ( 4.0A)
APU  A 200 ( 4.0A)
APU  A 200 ( 4.7A)
APU  A 200 ( 3.6A)
None
0.50A 4ae1A-1dtpA:
24.3
4ae1A-1dtpA:
99.47
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.
1ebl BETA-KETOACYL-ACP
SYNTHASE III


(Escherichia
coli)
PF08541
(ACP_syn_III_C)
PF08545
(ACP_syn_III)
4 GLY A   9
TYR A  11
ALA A  62
GLU A  57
None
0.95A 4ae1A-1eblA:
undetectable
4ae1A-1eblA:
23.08
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.
1efy POLY (ADP-RIBOSE)
POLYMERASE


(Gallus gallus)
PF00644
(PARP)
PF02877
(PARP_reg)
5 HIS A 862
GLY A 863
TYR A 896
TYR A 907
GLU A 988
BZC  A 201 (-4.0A)
BZC  A 201 (-3.9A)
BZC  A 201 (-4.0A)
BZC  A 201 (-3.6A)
BZC  A 201 (-4.0A)
0.43A 4ae1A-1efyA:
6.4
4ae1A-1efyA:
21.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ikp EXOTOXIN A

(Pseudomonas
aeruginosa)
PF09009
(Exotox-A_cataly)
PF09101
(Exotox-A_bind)
PF09102
(Exotox-A_target)
6 HIS A 440
GLY A 441
TYR A 470
ALA A 478
TYR A 481
GLU A 553
None
0.48A 4ae1A-1ikpA:
9.1
4ae1A-1ikpA:
22.76
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.
1jgu ANTIBODY HEAVY CHAIN

(Mus musculus)
PF07654
(C1-set)
PF07686
(V-set)
4 GLY H 104
TYR H  90
ALA H 105
TYR H  91
None
0.93A 4ae1A-1jguH:
3.8
4ae1A-1jguH:
19.22
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.
1k7y METHIONINE SYNTHASE

(Escherichia
coli)
PF02310
(B12-binding)
PF02607
(B12-binding_2)
PF02965
(Met_synt_B12)
4 GLY A1059
TYR A1111
ALA A1060
TYR A1181
None
SO4  A 267 (-4.8A)
None
None
0.99A 4ae1A-1k7yA:
undetectable
4ae1A-1k7yA:
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.
1m33 BIOH PROTEIN

(Escherichia
coli)
PF00561
(Abhydrolase_1)
4 GLY A 204
TYR A 228
ALA A 106
TYR A 203
None
0.95A 4ae1A-1m33A:
undetectable
4ae1A-1m33A:
20.04
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.
1mor GLUCOSAMINE
6-PHOSPHATE SYNTHASE


(Escherichia
coli)
PF01380
(SIS)
4 GLY A 471
TYR A 497
ALA A 479
TYR A 476
None
0.94A 4ae1A-1morA:
undetectable
4ae1A-1morA:
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.
1olp ALPHA-TOXIN

(Clostridium
sardiniense)
PF00882
(Zn_dep_PLPC)
PF01477
(PLAT)
4 HIS A 136
TYR A  65
ALA A  94
TYR A 127
ZN  A1374 (-3.4A)
None
None
None
0.97A 4ae1A-1olpA:
undetectable
4ae1A-1olpA:
20.55
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.
1pix GLUTACONYL-COA
DECARBOXYLASE A
SUBUNIT


(Acidaminococcus
fermentans)
PF01039
(Carboxyl_trans)
4 GLY A 378
TYR A 371
ALA A 377
GLU A 373
None
0.64A 4ae1A-1pixA:
undetectable
4ae1A-1pixA:
22.61
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.
1qok MFE-23 RECOMBINANT
ANTIBODY FRAGMENT


(Mus musculus)
PF07686
(V-set)
4 GLY A 259
TYR A 246
ALA A 260
TYR A 247
None
0.99A 4ae1A-1qokA:
3.9
4ae1A-1qokA:
21.94
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.
1r3n BETA-ALANINE
SYNTHASE


(Lachancea
kluyveri)
PF01546
(Peptidase_M20)
PF07687
(M20_dimer)
4 HIS A 323
GLY A 294
ALA A 289
GLU A 335
None
0.96A 4ae1A-1r3nA:
undetectable
4ae1A-1r3nA:
23.52
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.
1sb8 WBPP

(Pseudomonas
aeruginosa)
PF01370
(Epimerase)
4 HIS A  53
GLY A  52
ALA A  25
GLU A  59
None
NAD  A 342 (-2.9A)
NAD  A 342 (-4.2A)
None
0.74A 4ae1A-1sb8A:
undetectable
4ae1A-1sb8A:
20.71
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.
1ua7 ALPHA-AMYLASE

(Bacillus
subtilis)
PF00128
(Alpha-amylase)
4 GLY A 207
TYR A 223
ALA A 178
TYR A 220
None
0.98A 4ae1A-1ua7A:
undetectable
4ae1A-1ua7A:
23.49
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.
1vft ALANINE RACEMASE

(Streptomyces
lavendulae)
PF00842
(Ala_racemase_C)
PF01168
(Ala_racemase_N)
4 HIS A  44
GLY A  43
ALA A  41
TYR A  42
None
None
None
DCS  A 401 (-4.6A)
0.99A 4ae1A-1vftA:
undetectable
4ae1A-1vftA:
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.
1y56 HYPOTHETICAL PROTEIN
PH1363


(Pyrococcus
horikoshii)
PF07992
(Pyr_redox_2)
PF13510
(Fer2_4)
4 GLY A 367
ALA A 368
TYR A 369
GLU A 384
None
0.99A 4ae1A-1y56A:
undetectable
4ae1A-1y56A:
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.
1yce SUBUNIT C

(Ilyobacter
tartaricus)
PF00137
(ATP-synt_C)
4 GLY A  33
ALA A  35
TYR A  34
GLU A  41
None
0.97A 4ae1A-1yceA:
undetectable
4ae1A-1yceA:
10.08
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.
2ap2 SINGLE CHAIN FV

(Mus musculus)
PF07686
(V-set)
4 GLY A 105
TYR A  92
ALA A 106
TYR A  93
None
1.00A 4ae1A-2ap2A:
3.0
4ae1A-2ap2A:
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.
2d9c SIGNAL-REGULATORY
PROTEIN BETA-1


(Homo sapiens)
PF07686
(V-set)
4 GLY A 112
TYR A  94
ALA A 113
TYR A  95
None
0.85A 4ae1A-2d9cA:
4.0
4ae1A-2d9cA:
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.
2evr COG0791: CELL
WALL-ASSOCIATED
HYDROLASES
(INVASION-ASSOCIATED
PROTEINS)


(Nostoc
punctiforme)
PF00877
(NLPC_P60)
4 GLY A 163
TYR A 186
ALA A 162
TYR A 180
None
1.00A 4ae1A-2evrA:
undetectable
4ae1A-2evrA:
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.
2ho5 OXIDOREDUCTASE,
GFO/IDH/MOCA FAMILY


(Streptococcus
pneumoniae)
PF01408
(GFO_IDH_MocA)
4 GLY A 227
TYR A 181
ALA A 148
GLU A 251
None
0.99A 4ae1A-2ho5A:
undetectable
4ae1A-2ho5A:
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.
2hw2 RIFAMPIN ADP-RIBOSYL
TRANSFERASE


(Mycolicibacterium
smegmatis)
PF12120
(Arr-ms)
4 HIS A  19
GLY A  20
TYR A  49
ALA A  57
None
None
GLY  A 144 (-3.8A)
None
0.55A 4ae1A-2hw2A:
4.2
4ae1A-2hw2A:
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.
2jjv SIGNAL-REGULATORY
PROTEIN BETA 1.


(Homo sapiens)
PF07686
(V-set)
4 GLY A 107
TYR A  89
ALA A 108
TYR A  90
None
1.00A 4ae1A-2jjvA:
3.9
4ae1A-2jjvA:
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.
2pqf POLY [ADP-RIBOSE]
POLYMERASE 12


(Homo sapiens)
PF00644
(PARP)
4 HIS A 564
GLY A 565
TYR A 596
TYR A 607
GAB  A 701 ( 3.7A)
GAB  A 701 (-3.6A)
GAB  A 701 (-4.5A)
GAB  A 701 (-3.3A)
0.39A 4ae1A-2pqfA:
6.3
4ae1A-2pqfA:
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.
2qdd MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME


(Roseovarius
nubinhibens)
PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C)
4 GLY A  46
TYR A  35
ALA A 108
GLU A  49
None
0.96A 4ae1A-2qddA:
undetectable
4ae1A-2qddA:
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.
2qkb RIBONUCLEASE H1

(Homo sapiens)
PF00075
(RNase_H)
4 GLY A 161
TYR A 163
ALA A 277
GLU A 272
None
0.92A 4ae1A-2qkbA:
undetectable
4ae1A-2qkbA:
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.
2qty POLY(ADP-RIBOSE)
GLYCOHYDROLASE ARH3


(Mus musculus)
PF03747
(ADP_ribosyl_GH)
4 HIS A 166
GLY A 137
TYR A 133
ALA A 175
None
0.88A 4ae1A-2qtyA:
undetectable
4ae1A-2qtyA:
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.
2qua EXTRACELLULAR LIPASE

(Serratia
marcescens)
no annotation 4 GLY A 111
ALA A 119
TYR A 110
GLU A 122
None
0.95A 4ae1A-2quaA:
undetectable
4ae1A-2quaA:
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.
2rfg DIHYDRODIPICOLINATE
SYNTHASE


(Hahella
chejuensis)
PF00701
(DHDPS)
4 GLY A 104
ALA A 103
TYR A 105
GLU A  83
None
0.96A 4ae1A-2rfgA:
undetectable
4ae1A-2rfgA:
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.
2vc2 INTEGRIN ALPHA-IIB

(Homo sapiens)
PF01839
(FG-GAP)
PF13517
(VCBS)
4 GLY A 381
TYR A 353
ALA A 378
GLU A 324
None
0.76A 4ae1A-2vc2A:
undetectable
4ae1A-2vc2A:
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.
2w9m POLYMERASE X

(Deinococcus
radiodurans)
PF14520
(HHH_5)
PF14716
(HHH_8)
4 GLY A 166
TYR A 228
ALA A 165
GLU A 229
None
0.94A 4ae1A-2w9mA:
undetectable
4ae1A-2w9mA:
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.
2xn8 PUTATIVE CYTOCHROME
P450 125


(Mycobacterium
tuberculosis)
PF00067
(p450)
4 GLY A 222
ALA A 224
TYR A 223
GLU A 230
None
0.87A 4ae1A-2xn8A:
undetectable
4ae1A-2xn8A:
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.
3aeh HEMOGLOBIN-BINDING
PROTEASE HBP
AUTOTRANSPORTER


(Escherichia
coli)
PF03797
(Autotransporter)
4 GLY A1253
ALA A1228
TYR A1227
GLU A1249
None
0.86A 4ae1A-3aehA:
undetectable
4ae1A-3aehA:
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.
3b78 EXOTOXIN A

(Pseudomonas
aeruginosa)
PF09009
(Exotox-A_cataly)
6 HIS B 440
GLY B 441
TYR B 470
ALA B 478
TYR B 481
GLU B 553
NAD  B 700 (-3.9A)
NAD  B 700 (-3.9A)
NAD  B 700 (-3.9A)
NAD  B 700 (-3.6A)
NAD  B 700 (-3.4A)
NAD  B 700 (-3.5A)
0.49A 4ae1A-3b78B:
9.4
4ae1A-3b78B:
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.
3c3v ARACHIN ARAH3
ISOFORM


(Arachis
hypogaea)
PF00190
(Cupin_1)
4 HIS A 445
GLY A 444
ALA A 419
GLU A 440
None
0.92A 4ae1A-3c3vA:
2.9
4ae1A-3c3vA:
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.
3c49 POLY(ADP-RIBOSE)
POLYMERASE 3


(Homo sapiens)
PF00644
(PARP)
PF02877
(PARP_reg)
5 HIS A 384
GLY A 385
TYR A 414
TYR A 425
GLU A 514
KU8  A 601 (-4.0A)
KU8  A 601 (-3.5A)
KU8  A 601 (-4.1A)
KU8  A 601 (-3.5A)
KU8  A 601 (-3.9A)
0.49A 4ae1A-3c49A:
6.3
4ae1A-3c49A:
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.
3dsm UNCHARACTERIZED
PROTEIN BACUNI_02894


(Bacteroides
uniformis)
no annotation 4 GLY A  57
TYR A  49
ALA A  31
GLU A  46
None
0.99A 4ae1A-3dsmA:
undetectable
4ae1A-3dsmA:
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.
3gwe 3-OXOACYL-(ACYL-CARR
IER-PROTEIN)
SYNTHASE III


(Burkholderia
pseudomallei)
PF08541
(ACP_syn_III_C)
PF08545
(ACP_syn_III)
4 GLY A 194
ALA A 197
TYR A 335
GLU A 238
None
0.98A 4ae1A-3gweA:
undetectable
4ae1A-3gweA:
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.
3h7v O-SUCCINYLBENZOATE
SYNTHASE


(Thermosynechococcus
elongatus)
PF13378
(MR_MLE_C)
4 GLY A  41
TYR A  30
ALA A  92
GLU A  44
None
0.97A 4ae1A-3h7vA:
undetectable
4ae1A-3h7vA:
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.
3hi0 PUTATIVE
EXOPOLYPHOSPHATASE


(Agrobacterium
fabrum)
PF02541
(Ppx-GppA)
4 GLY A 439
ALA A 406
TYR A 409
GLU A 433
None
0.97A 4ae1A-3hi0A:
undetectable
4ae1A-3hi0A:
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.
3hkv POLY [ADP-RIBOSE]
POLYMERASE 10


(Homo sapiens)
PF00644
(PARP)
4 HIS A 887
GLY A 888
TYR A 919
TYR A 932
3AB  A1025 (-3.8A)
3AB  A1025 (-3.5A)
3AB  A1025 (-4.4A)
3AB  A1025 (-3.7A)
0.29A 4ae1A-3hkvA:
6.2
4ae1A-3hkvA:
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.
3hmc PUTATIVE PROPHAGE
LAMBDABA04, GLYCOSYL
HYDROLASE, FAMILY 25


(Bacillus
anthracis)
PF01183
(Glyco_hydro_25)
4 TYR A 124
ALA A  62
TYR A  61
GLU A  95
MES  A 400 (-3.6A)
None
MES  A 400 (-4.0A)
MES  A 400 (-3.5A)
0.87A 4ae1A-3hmcA:
undetectable
4ae1A-3hmcA:
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.
3il3 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 3


(Haemophilus
influenzae)
PF08541
(ACP_syn_III_C)
PF08545
(ACP_syn_III)
4 GLY A   9
TYR A  11
ALA A  62
GLU A  57
None
0.92A 4ae1A-3il3A:
undetectable
4ae1A-3il3A:
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.
3il7 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 3


(Staphylococcus
aureus)
PF08541
(ACP_syn_III_C)
PF08545
(ACP_syn_III)
4 GLY A   9
TYR A  11
ALA A  62
GLU A  57
None
0.98A 4ae1A-3il7A:
undetectable
4ae1A-3il7A:
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.
3iy7 FRAGMENT FROM
NEUTRALIZING
ANTIBODY F (LIGHT
CHAIN)


(Rattus
norvegicus)
PF07686
(V-set)
4 GLY A  96
TYR A  84
ALA A  97
TYR A  85
None
0.98A 4ae1A-3iy7A:
2.8
4ae1A-3iy7A:
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.
3jb9 PRE-MRNA-SPLICING
FACTOR SPP42


(Schizosaccharomyces
pombe)
PF08082
(PRO8NT)
PF08083
(PROCN)
PF10596
(U6-snRNA_bdg)
PF10597
(U5_2-snRNA_bdg)
PF10598
(RRM_4)
PF12134
(PRP8_domainIV)
4 HIS A 602
GLY A 651
TYR A 603
ALA A 598
None
0.87A 4ae1A-3jb9A:
undetectable
4ae1A-3jb9A:
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.
3ki6 CHOLIX TOXIN

(Vibrio cholerae)
PF09009
(Exotox-A_cataly)
6 HIS A 460
GLY A 461
TYR A 493
ALA A 501
TYR A 504
GLU A 581
G9L  A   1 (-3.9A)
G9L  A   1 (-3.7A)
G9L  A   1 (-4.5A)
G9L  A   1 (-3.4A)
G9L  A   1 (-3.5A)
G9L  A   1 (-4.6A)
0.55A 4ae1A-3ki6A:
8.8
4ae1A-3ki6A:
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.
3mn1 PROBABLE YRBI FAMILY
PHOSPHATASE


(Pseudomonas
savastanoi)
PF08282
(Hydrolase_3)
4 HIS A 145
GLY A 130
ALA A 112
GLU A 109
None
0.94A 4ae1A-3mn1A:
undetectable
4ae1A-3mn1A:
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.
3p30 1281 FAB LIGHT CHAIN

(Homo sapiens)
PF07654
(C1-set)
PF07686
(V-set)
4 GLY L  99
TYR L  86
ALA L 100
TYR L  87
None
1.00A 4ae1A-3p30L:
undetectable
4ae1A-3p30L:
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.
3q9o EXOTOXIN A

(Vibrio cholerae)
PF09009
(Exotox-A_cataly)
PF09101
(Exotox-A_bind)
PF09102
(Exotox-A_target)
6 HIS A 460
GLY A 461
TYR A 493
ALA A 501
TYR A 504
GLU A 581
NAD  A 700 (-3.8A)
NAD  A 700 (-3.7A)
NAD  A 700 ( 3.7A)
NAD  A 700 (-3.5A)
NAD  A 700 (-3.4A)
NAD  A 700 (-3.2A)
0.55A 4ae1A-3q9oA:
9.7
4ae1A-3q9oA:
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.
3qfk UNCHARACTERIZED
PROTEIN


(Staphylococcus
aureus)
PF00149
(Metallophos)
PF02872
(5_nucleotid_C)
4 GLY A 142
TYR A 175
ALA A 183
GLU A 178
None
0.97A 4ae1A-3qfkA:
undetectable
4ae1A-3qfkA:
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.
3ro2 G-PROTEIN-SIGNALING
MODULATOR 2


(Mus musculus)
PF13176
(TPR_7)
PF13424
(TPR_12)
4 GLY A 242
ALA A 244
TYR A 245
GLU A 219
None
0.99A 4ae1A-3ro2A:
2.6
4ae1A-3ro2A:
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.
3ro3 G-PROTEIN-SIGNALING
MODULATOR 2


(Mus musculus)
PF13424
(TPR_12)
4 GLY A 242
ALA A 244
TYR A 245
GLU A 219
None
0.96A 4ae1A-3ro3A:
undetectable
4ae1A-3ro3A:
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.
3ruc WBGU

(Plesiomonas
shigelloides)
PF01370
(Epimerase)
4 HIS A  53
GLY A  52
ALA A  25
GLU A  59
None
NAD  A 343 (-3.0A)
NAD  A 343 (-4.3A)
None
0.76A 4ae1A-3rucA:
undetectable
4ae1A-3rucA:
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.
3t94 5'-METHYLTHIOADENOSI
NE PHOSPHORYLASE
(MTAP)


(Sulfolobus
solfataricus)
PF01048
(PNP_UDP_1)
4 GLY A  37
ALA A  74
TYR A  36
GLU A 119
None
0.92A 4ae1A-3t94A:
undetectable
4ae1A-3t94A:
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.
3tqp ENOLASE

(Coxiella
burnetii)
PF00113
(Enolase_C)
PF03952
(Enolase_N)
4 GLY A 360
ALA A 333
TYR A 359
GLU A 304
None
0.78A 4ae1A-3tqpA:
2.4
4ae1A-3tqpA:
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.
3ve2 TRANSFERRIN-BINDING
PROTEIN 2


(Neisseria
meningitidis)
PF01298
(TbpB_B_D)
PF17483
(TbpB_C)
PF17484
(TbpB_A)
4 HIS A 129
ALA A 344
TYR A 182
GLU A 325
GOL  A 706 (-4.2A)
None
None
None
0.99A 4ae1A-3ve2A:
undetectable
4ae1A-3ve2A:
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.
3vpz GLUCOKINASE

(Pseudoalteromonas
sp. AS-131)
PF02685
(Glucokinase)
4 GLY A 320
ALA A 115
TYR A 118
GLU A 108
None
0.82A 4ae1A-3vpzA:
undetectable
4ae1A-3vpzA:
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.
3vtf UDP-GLUCOSE
6-DEHYDROGENASE


(Pyrobaculum
islandicum)
PF00984
(UDPG_MGDP_dh)
PF03720
(UDPG_MGDP_dh_C)
PF03721
(UDPG_MGDP_dh_N)
4 GLY A  29
ALA A  68
TYR A  30
GLU A  72
None
0.94A 4ae1A-3vtfA:
undetectable
4ae1A-3vtfA:
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.
3zk2 ATP SYNTHASE SUBUNIT
C


(Fusobacterium
nucleatum)
PF00137
(ATP-synt_C)
4 GLY A  33
ALA A  35
TYR A  34
GLU A  41
None
0.99A 4ae1A-3zk2A:
undetectable
4ae1A-3zk2A:
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.
4ade SUCCINYLORNITHINE
TRANSAMINASE


(Escherichia
coli)
PF00202
(Aminotran_3)
4 HIS A 127
GLY A 125
ALA A 120
TYR A 124
None
0.98A 4ae1A-4adeA:
undetectable
4ae1A-4adeA:
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.
4ae0 DIPHTHERIA TOXIN

(Corynebacterium
diphtheriae)
PF01324
(Diphtheria_R)
PF02763
(Diphtheria_C)
PF02764
(Diphtheria_T)
6 HIS A  21
GLY A  22
TYR A  54
ALA A  62
TYR A  65
GLU A 148
None
0.41A 4ae1A-4ae0A:
48.6
4ae1A-4ae0A:
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.
4bem F1FO ATPASE C1
SUBUNIT


(Acetobacterium
woodii)
PF00137
(ATP-synt_C)
4 GLY J 130
ALA J 132
TYR J 131
GLU J 138
None
0.94A 4ae1A-4bemJ:
undetectable
4ae1A-4bemJ:
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.
4bt6 ALPHA-ACETOLACTATE
DECARBOXYLASE


(Brevibacillus
brevis)
PF03306
(AAL_decarboxy)
4 HIS A 196
GLY A 206
ALA A 144
GLU A 255
ZN  A1257 ( 3.3A)
None
None
None
0.95A 4ae1A-4bt6A:
undetectable
4ae1A-4bt6A:
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.
4f0d POLY [ADP-RIBOSE]
POLYMERASE 16


(Homo sapiens)
PF00644
(PARP)
5 HIS A 152
GLY A 153
TYR A 182
ALA A 190
TYR A 193
3AB  A 301 (-4.0A)
3AB  A 301 (-3.4A)
3AB  A 301 (-4.3A)
3AB  A 301 (-3.9A)
3AB  A 301 (-3.8A)
0.43A 4ae1A-4f0dA:
5.0
4ae1A-4f0dA:
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.
4f0e POLY [ADP-RIBOSE]
POLYMERASE 15


(Homo sapiens)
PF00644
(PARP)
4 HIS A 537
GLY A 538
TYR A 569
TYR A 582
0RU  A 701 (-3.7A)
0RU  A 701 (-3.3A)
0RU  A 701 (-4.3A)
0RU  A 701 (-3.7A)
0.30A 4ae1A-4f0eA:
6.1
4ae1A-4f0eA:
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.
4l2k TANKYRASE-2

(Homo sapiens)
PF00644
(PARP)
4 HIS A1031
GLY A1032
TYR A1060
TYR A1071
1V8  A1201 (-4.2A)
1V8  A1201 (-3.7A)
1V8  A1201 (-4.7A)
1V8  A1201 (-3.3A)
0.39A 4ae1A-4l2kA:
2.9
4ae1A-4l2kA:
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.
4oa7 TANKYRASE-1

(Homo sapiens)
PF00644
(PARP)
5 HIS A1184
GLY A1185
TYR A1213
TYR A1224
GLU A1291
2XS  A1402 (-4.2A)
None
2XS  A1402 (-4.2A)
2XS  A1402 ( 3.9A)
None
0.83A 4ae1A-4oa7A:
6.3
4ae1A-4oa7A:
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.
4oqa POLY [ADP-RIBOSE]
POLYMERASE 1


(Homo sapiens)
PF00644
(PARP)
PF02877
(PARP_reg)
PF05406
(WGR)
5 HIS C 862
GLY C 863
TYR C 896
TYR C 907
GLU C 988
2US  C1101 (-3.7A)
2US  C1101 (-3.3A)
2US  C1101 (-4.2A)
2US  C1101 (-3.5A)
2US  C1101 (-3.2A)
0.53A 4ae1A-4oqaC:
6.3
4ae1A-4oqaC:
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.
4p48 ANTIBODY SCFV 180

(Gallus gallus)
PF07686
(V-set)
4 GLY A 102
TYR A  87
ALA A 103
TYR A  88
None
0.98A 4ae1A-4p48A:
3.5
4ae1A-4p48A:
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.
4p49 ANTIBODY SCFV B8

(Gallus gallus)
PF07686
(V-set)
4 GLY A  94
TYR A  81
ALA A  95
TYR A  82
None
1.00A 4ae1A-4p49A:
3.7
4ae1A-4p49A:
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.
4ptf DNA POLYMERASE
EPSILON CATALYTIC
SUBUNIT A


(Saccharomyces
cerevisiae)
PF00136
(DNA_pol_B)
PF03104
(DNA_pol_B_exo1)
4 GLY A 564
TYR A 969
ALA A 563
GLU A 873
None
0.90A 4ae1A-4ptfA:
undetectable
4ae1A-4ptfA:
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.
4py4 POLY [ADP-RIBOSE]
POLYMERASE 14


(Homo sapiens)
PF00644
(PARP)
4 HIS A1682
GLY A1683
TYR A1714
TYR A1727
XL2  A1901 (-4.0A)
XL2  A1901 (-3.6A)
XL2  A1901 (-3.7A)
XL2  A1901 (-3.6A)
0.29A 4ae1A-4py4A:
6.8
4ae1A-4py4A:
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.
4sli INTRAMOLECULAR
TRANS-SIALIDASE


(Macrobdella
decora)
PF02973
(Sialidase)
PF13088
(BNR_2)
4 GLY A 237
TYR A 152
TYR A 246
GLU A 162
None
0.98A 4ae1A-4sliA:
undetectable
4ae1A-4sliA:
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.
4x8k RNA POLYMERASE SIGMA
FACTOR SIGA


(Mycobacterium
tuberculosis)
PF00140
(Sigma70_r1_2)
PF04542
(Sigma70_r2)
4 GLY A 256
ALA A 259
TYR A 258
GLU A 265
None
0.94A 4ae1A-4x8kA:
undetectable
4ae1A-4x8kA:
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.
4zzy POLY [ADP-RIBOSE]
POLYMERASE 2


(Homo sapiens)
PF00644
(PARP)
PF02877
(PARP_reg)
5 HIS A 428
GLY A 429
TYR A 462
TYR A 473
GLU A 558
D7N  A1584 (-3.6A)
D7N  A1584 (-3.8A)
D7N  A1584 (-3.7A)
D7N  A1584 (-3.8A)
D7N  A1584 (-3.9A)
0.60A 4ae1A-4zzyA:
6.1
4ae1A-4zzyA:
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.
5bp3 MYCOCEROSIC ACID
SYNTHASE-LIKE
POLYKETIDE SYNTHASE


(Mycolicibacterium
smegmatis)
PF14765
(PS-DH)
4 GLY A1132
ALA A1130
TYR A1131
GLU A1157
None
0.90A 4ae1A-5bp3A:
undetectable
4ae1A-5bp3A:
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.
5dcz TANKYRASE-2

(Homo sapiens)
PF00644
(PARP)
4 HIS A1031
GLY A1032
TYR A1060
TYR A1071
59B  A1203 (-4.1A)
59B  A1203 (-4.1A)
59B  A1203 (-4.3A)
59B  A1203 (-3.3A)
0.29A 4ae1A-5dczA:
6.8
4ae1A-5dczA:
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.
5dcz TANKYRASE-2

(Homo sapiens)
PF00644
(PARP)
4 HIS A1031
GLY A1032
TYR A1071
GLU A1138
59B  A1203 (-4.1A)
59B  A1203 (-4.1A)
59B  A1203 (-3.3A)
59B  A1203 (-3.7A)
0.77A 4ae1A-5dczA:
6.8
4ae1A-5dczA:
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.
5dsy POLY [ADP-RIBOSE]
POLYMERASE 2


(Homo sapiens)
PF00644
(PARP)
5 HIS A 415
GLY A 416
TYR A 449
TYR A 460
GLU A 545
UHB  A1001 (-3.7A)
UHB  A1001 (-3.9A)
UHB  A1001 (-3.8A)
UHB  A1001 (-3.4A)
UHB  A1001 (-3.5A)
0.69A 4ae1A-5dsyA:
5.4
4ae1A-5dsyA:
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.
5f7u CYCLOALTERNAN-FORMIN
G ENZYME


(Listeria
monocytogenes)
PF01055
(Glyco_hydro_31)
PF13802
(Gal_mutarotas_2)
PF16338
(DUF4968)
PF16990
(CBM_35)
4 GLY A 936
TYR A 938
ALA A 922
TYR A 937
None
0.96A 4ae1A-5f7uA:
3.2
4ae1A-5f7uA:
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.
5ghs SSDNA-SPECIFIC
EXONUCLEASE


(Thermococcus
kodakarensis)
PF02272
(DHHA1)
4 GLY A 314
TYR A 325
ALA A 316
GLU A 322
None
1.00A 4ae1A-5ghsA:
undetectable
4ae1A-5ghsA:
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.
5hqw PUTATIVE POLYKETIDE
SYNTHASE


(Brevibacillus
brevis)
PF14765
(PS-DH)
4 HIS A2332
TYR A2319
ALA A2290
GLU A2317
None
1.01A 4ae1A-5hqwA:
undetectable
4ae1A-5hqwA:
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.
5k8o 5-NITROANTHRANILIC
ACID AMINOHYDROLASE


(Bradyrhizobium
sp.)
PF01546
(Peptidase_M20)
PF07687
(M20_dimer)
4 GLY A  39
TYR A  46
ALA A  40
GLU A  47
None
0.93A 4ae1A-5k8oA:
undetectable
4ae1A-5k8oA:
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.
5l2l NAB2P

(Saccharomyces
cerevisiae)
PF14608
(zf-CCCH_2)
4 HIS A 430
GLY A 418
TYR A 428
GLU A 413
ZN  A 501 (-3.3A)
None
A  G   3 ( 3.9A)
ZN  A 504 (-2.6A)
0.70A 4ae1A-5l2lA:
undetectable
4ae1A-5l2lA:
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.
5lx6 POLY [ADP-RIBOSE]
POLYMERASE 10


(Homo sapiens)
PF00644
(PARP)
4 HIS A 887
GLY A 888
TYR A 919
TYR A 932
78P  A1101 (-4.0A)
78P  A1101 (-3.7A)
78P  A1101 (-3.7A)
78P  A1101 (-3.8A)
0.34A 4ae1A-5lx6A:
6.0
4ae1A-5lx6A:
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.
5nh2 UNCHARACTERIZED
PROTEIN


(Bartonella
henselae)
no annotation 4 GLY B  49
ALA B  51
TYR B  50
GLU B  17
GLY  B  49 ( 0.0A)
ALA  B  51 ( 0.0A)
TYR  B  50 ( 1.3A)
GLU  B  17 ( 0.5A)
0.91A 4ae1A-5nh2B:
undetectable
4ae1A-5nh2B:
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.
5ols RHAMNOGALACTURONAN
LYASE


(Bacteroides
thetaiotaomicron)
no annotation 4 HIS A 326
GLY A 287
ALA A 286
GLU A 307
None
0.93A 4ae1A-5olsA:
undetectable
4ae1A-5olsA:
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.
5ovc SH3 AND MULTIPLE
ANKYRIN REPEAT
DOMAINS PROTEIN 3


(Rattus
norvegicus)
no annotation 4 HIS A 652
GLY A 597
ALA A 598
GLU A 601
None
0.98A 4ae1A-5ovcA:
undetectable
4ae1A-5ovcA:
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.
5oy0 PHOTOSYSTEM I P700
CHLOROPHYLL A
APOPROTEIN A1


(Synechocystis
sp. PCC 6803)
no annotation 4 HIS 1 590
GLY 1 587
TYR 1 555
ALA 1 409
None
0.92A 4ae1A-5oy01:
undetectable
4ae1A-5oy01:
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.
5xst POLY [ADP-RIBOSE]
POLYMERASE 1


(Homo sapiens)
no annotation 5 HIS A 201
GLY A 202
TYR A 235
TYR A 246
GLU A 327
8E6  A 401 (-3.5A)
8E6  A 401 (-3.9A)
8E6  A 401 (-4.1A)
8E6  A 401 (-3.4A)
8E6  A 401 (-3.9A)
0.57A 4ae1A-5xstA:
6.6
4ae1A-5xstA:
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.
6bhv POLY [ADP-RIBOSE]
POLYMERASE 1


(Homo sapiens)
no annotation 5 HIS A 862
GLY A 863
TYR A 896
TYR A 907
GLU A 988
DQV  A1101 (-3.6A)
DQV  A1101 (-3.8A)
DQV  A1101 (-3.5A)
DQV  A1101 (-3.7A)
DQV  A1101 (-3.3A)
0.57A 4ae1A-6bhvA:
6.5
4ae1A-6bhvA:
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.
6ejm SINGLE CHAIN FV
FRAGMENT


(Mus musculus)
no annotation 4 GLY H 278
TYR H 265
ALA H 279
TYR H 266
None
0.98A 4ae1A-6ejmH:
3.3
4ae1A-6ejmH:
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.
6er3 BNR/ASP-BOX REPEAT
PROTEIN


([Ruminococcus]
gnavus)
no annotation 4 GLY A 160
TYR A  75
TYR A 169
GLU A  85
None
SIA  A 201 ( 4.4A)
None
SIA  A 201 (-3.1A)
1.00A 4ae1A-6er3A:
undetectable
4ae1A-6er3A:
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.
6esq HYDROXYMETHYLGLUTARY
L-COA SYNTHASE


(Methanothermococcus
thermolithotrophicus)
no annotation 4 GLY I  10
TYR I  12
ALA I  63
GLU I  58
None
0.89A 4ae1A-6esqI:
undetectable
4ae1A-6esqI:
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.
6f34 AMINO ACID
TRANSPORTER


(Geobacillus
kaustophilus)
no annotation 4 GLY A 221
ALA A  57
TYR A 217
GLU A  55
None
0.88A 4ae1A-6f34A:
undetectable
4ae1A-6f34A:
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.
6fhw GLUCOAMYLASE P

(Amorphotheca
resinae)
no annotation 4 HIS A 111
GLY A 497
ALA A 496
GLU A 107
None
0.86A 4ae1A-6fhwA:
undetectable
4ae1A-6fhwA:
undetectable