SIMILAR PATTERNS OF AMINO ACIDS FOR 4ZJL_A_ERYA1101_0

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.
1cjy PROTEIN (CYTOSOLIC
PHOSPHOLIPASE A2)


(Homo sapiens)
PF00168
(C2)
PF01735
(PLA2_B)
5 SER A 140
SER A 147
LEU A 367
THR A 376
GLY A 375
None
1.43A 4zjlA-1cjyA:
0.0
4zjlA-1cjyA:
21.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1gwc GLUTATHIONE
S-TRANSFERASE TSI-1


(Aegilops
tauschii)
PF00043
(GST_C)
PF02798
(GST_N)
5 SER A  69
SER A 170
PHE A 184
PHE A 199
LEU A  27
GTX  A1225 (-2.7A)
None
None
None
None
1.39A 4zjlA-1gwcA:
0.0
4zjlA-1gwcA:
13.02
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.
1h0h FORMATE
DEHYDROGENASE
SUBUNIT ALPHA


(Desulfovibrio
gigas)
PF00384
(Molybdopterin)
PF01568
(Molydop_binding)
PF04879
(Molybdop_Fe4S4)
5 SER A 853
PHE A 836
LEU A 236
GLY A 192
MET A 191
MGD  A1002 ( 4.0A)
None
None
MGD  A1002 (-3.7A)
None
1.39A 4zjlA-1h0hA:
0.0
4zjlA-1h0hA:
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.
1lcs FELINE LEUKEMIA
VIRUS
RECEPTOR-BINDING
DOMAIN


(Feline leukemia
virus)
PF00429
(TLV_coat)
5 SER A 115
PHE A 197
LEU A 165
THR A 168
GLY A 171
None
1.09A 4zjlA-1lcsA:
undetectable
4zjlA-1lcsA:
10.96
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.
1nt4 GLUCOSE-1-PHOSPHATAS
E


(Escherichia
coli)
PF00328
(His_Phos_2)
5 MET A 379
MET A 335
PHE A 322
LEU A 296
THR A 126
None
1.28A 4zjlA-1nt4A:
2.3
4zjlA-1nt4A:
16.24
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.
1orr CDP-TYVELOSE-2-EPIME
RASE


(Salmonella
enterica)
PF16363
(GDP_Man_Dehyd)
5 SER A 123
PHE A 250
LEU A   4
THR A   7
GLY A   8
NAD  A1200 (-3.1A)
None
None
None
NAD  A1200 (-3.2A)
1.36A 4zjlA-1orrA:
undetectable
4zjlA-1orrA:
15.33
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.
1squ CHEX PROTEIN

(Thermotoga
maritima)
PF13690
(CheX)
5 SER A  61
PHE A 140
LEU A  21
THR A  96
GLY A  93
None
1.34A 4zjlA-1squA:
undetectable
4zjlA-1squA:
10.50
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.
1y9q TRANSCRIPTIONAL
REGULATOR, HTH_3
FAMILY


(Vibrio cholerae)
PF01381
(HTH_3)
5 SER A 120
PHE A   8
PHE A  70
LEU A  63
GLY A  35
None
1.41A 4zjlA-1y9qA:
undetectable
4zjlA-1y9qA:
11.25
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.
1zx5 MANNOSEPHOSPHATE
ISOMERASE, PUTATIVE


(Archaeoglobus
fulgidus)
PF01238
(PMI_typeI)
5 SER A  59
PHE A  82
PHE A  41
GLU A 264
GLY A  55
None
1.39A 4zjlA-1zx5A:
0.0
4zjlA-1zx5A:
14.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2c2g THREONINE SYNTHASE

(Arabidopsis
thaliana)
PF00291
(PALP)
5 SER A 220
MET A 391
MET A 388
THR A 192
GLY A 193
None
None
None
None
PLP  A1163 ( 3.9A)
1.12A 4zjlA-2c2gA:
undetectable
4zjlA-2c2gA:
18.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2cxj S100 CALCIUM-BINDING
PROTEIN A13


(Mus musculus)
PF01023
(S_100)
5 SER A  32
PHE A  23
GLU A  86
LEU A  41
GLY A  81
None
1.49A 4zjlA-2cxjA:
undetectable
4zjlA-2cxjA:
7.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2d52 PENTAKETIDE CHROMONE
SYNTHASE


(Aloe
arborescens)
PF00195
(Chal_sti_synt_N)
PF02797
(Chal_sti_synt_C)
5 SER A 145
GLU A 205
LEU A 140
THR A 120
GLY A 119
None
1.10A 4zjlA-2d52A:
undetectable
4zjlA-2d52A:
18.68
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.
2dyk GTP-BINDING PROTEIN

(Thermus
thermophilus)
PF01926
(MMR_HSR1)
5 PHE A  51
GLU A 154
LEU A  21
THR A 141
GLY A 148
None
1.40A 4zjlA-2dykA:
undetectable
4zjlA-2dykA:
10.37
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.
2y6p 3-DEOXY-MANNO-OCTULO
SONATE
CYTIDYLYLTRANSFERASE


(Aquifex
aeolicus)
PF02348
(CTP_transf_3)
5 PHE A 108
GLU A 195
LEU A 199
GLY A 181
MET A 183
None
IPA  A1236 (-3.9A)
None
None
None
1.37A 4zjlA-2y6pA:
undetectable
4zjlA-2y6pA:
11.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2yg6 PUTRESCINE OXIDASE

(Rhodococcus
erythropolis)
PF01593
(Amino_oxidase)
5 SER A 343
SER A 182
GLU A 324
LEU A 199
GLY A 166
None
1.14A 4zjlA-2yg6A:
undetectable
4zjlA-2yg6A:
21.01
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.
2ylz PHENYLACETONE
MONOOXYGENASE


(Thermobifida
fusca)
PF13738
(Pyr_redox_3)
5 SER A 374
PHE A 215
GLU A 364
LEU A 383
GLY A 163
None
1.44A 4zjlA-2ylzA:
1.0
4zjlA-2ylzA:
18.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3b3j HISTONE-ARGININE
METHYLTRANSFERASE
CARM1


(Rattus
norvegicus)
PF06325
(PrmA)
5 PHE A 336
PHE A 423
LEU A 435
THR A 460
GLY A 461
None
1.16A 4zjlA-3b3jA:
undetectable
4zjlA-3b3jA:
18.41
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.
3d23 3C-LIKE PROTEINASE

(Human
coronavirus
HKU1)
no annotation 5 SER B 240
PHE B 273
GLU B 287
LEU B 248
GLY B 109
None
1.48A 4zjlA-3d23B:
undetectable
4zjlA-3d23B:
15.78
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.
3g6s PUTATIVE
ENDONUCLEASE/EXONUCL
EASE/PHOSPHATASE
FAMILY PROTEIN


(Bacteroides
vulgatus)
PF03372
(Exo_endo_phos)
5 PHE A  33
GLU A 242
LEU A 255
THR A 203
GLY A 204
None
1.48A 4zjlA-3g6sA:
undetectable
4zjlA-3g6sA:
14.87
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.
3hzt CALCIUM-DEPENDENT
PROTEIN KINASE 3


(Toxoplasma
gondii)
PF00069
(Pkinase)
PF13499
(EF-hand_7)
5 SER A 465
MET A 527
PHE A 520
GLU A 160
GLY A  83
None
None
None
GOL  A 542 (-3.8A)
J60  A 540 ( 4.3A)
1.45A 4zjlA-3hztA:
undetectable
4zjlA-3hztA:
18.55
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.
3j23 CAPSID PROTEIN VP1
CAPSID PROTEIN VP3


(Enterovirus A;
Enterovirus A)
PF00073
(Rhv)
PF00073
(Rhv)
5 MET A 129
PHE A 204
PHE A 126
LEU C  43
GLY C 106
None
0.96A 4zjlA-3j23A:
undetectable
4zjlA-3j23A:
11.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3m9v FAD-DEPENDENT
OXIDOREDUCTASE


(Actinomadura
kijaniata)
PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N)
5 MET A 327
GLU A 113
LEU A  79
THR A  66
GLY A 107
None
TYD  A 901 (-3.8A)
None
None
None
1.33A 4zjlA-3m9vA:
undetectable
4zjlA-3m9vA:
18.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ot4 PUTATIVE
ISOCHORISMATASE


(Bordetella
bronchiseptica)
PF00857
(Isochorismatase)
5 SER A 154
SER A  84
PHE A  40
THR A 126
GLY A 125
CSO  A 150 ( 2.6A)
None
None
None
None
1.28A 4zjlA-3ot4A:
undetectable
4zjlA-3ot4A:
13.41
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.
3t95 AUTOINDUCER
2-BINDING PROTEIN
LSRB


(Yersinia pestis)
PF13407
(Peripla_BP_4)
5 SER A  90
MET A 142
MET A 138
LEU A 323
GLY A  44
PAV  A 400 ( 4.5A)
None
None
None
None
1.39A 4zjlA-3t95A:
1.6
4zjlA-3t95A:
16.11
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.
3tw5 TRANSGLUTAMINASE
ELICITOR


(Phytophthora
sojae)
PF16683
(TGase_elicitor)
5 SER A 197
SER A 290
GLU A 444
LEU A 439
THR A 461
None
1.44A 4zjlA-3tw5A:
undetectable
4zjlA-3tw5A:
16.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3v98 ARACHIDONATE
5-LIPOXYGENASE


(Homo sapiens)
PF00305
(Lipoxygenase)
PF01477
(PLAT)
5 PHE A 151
GLU A 417
LEU A 368
THR A 427
GLY A 428
None
1.19A 4zjlA-3v98A:
undetectable
4zjlA-3v98A:
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.
3vwa CYTOPLASMIC EXPORT
PROTEIN 1


(Saccharomyces
cerevisiae)
no annotation 5 SER A 139
PHE A 167
LEU A 182
GLY A 194
MET A 193
None
1.36A 4zjlA-3vwaA:
undetectable
4zjlA-3vwaA:
19.32
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.
3w6o DYNAMIN-1-LIKE
PROTEIN


(Homo sapiens)
PF00350
(Dynamin_N)
PF01031
(Dynamin_M)
5 SER A  40
GLU A  89
LEU A  67
GLY A  -1
MET A   1
GCP  A 801 (-2.6A)
None
None
None
None
1.44A 4zjlA-3w6oA:
undetectable
4zjlA-3w6oA:
16.89
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3w9h ACRIFLAVINE
RESISTANCE PROTEIN B


(Escherichia
coli)
PF00873
(ACR_tran)
6 SER A  79
MET A 573
GLU A 673
GLU A 683
LEU A 828
THR A 860
None
1.10A 4zjlA-3w9hA:
59.1
4zjlA-3w9hA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3w9h ACRIFLAVINE
RESISTANCE PROTEIN B


(Escherichia
coli)
PF00873
(ACR_tran)
8 SER A  79
MET A 575
PHE A 615
GLU A 683
LEU A 828
THR A 860
GLY A 861
MET A 862
None
1.13A 4zjlA-3w9hA:
59.1
4zjlA-3w9hA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3w9h ACRIFLAVINE
RESISTANCE PROTEIN B


(Escherichia
coli)
PF00873
(ACR_tran)
6 SER A  79
SER A 133
GLU A 683
THR A 860
GLY A 861
MET A 862
None
1.03A 4zjlA-3w9hA:
59.1
4zjlA-3w9hA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3w9h ACRIFLAVINE
RESISTANCE PROTEIN B


(Escherichia
coli)
PF00873
(ACR_tran)
9 SER A  79
SER A 135
MET A 573
PHE A 615
GLU A 683
LEU A 828
THR A 860
GLY A 861
MET A 862
None
0.86A 4zjlA-3w9hA:
59.1
4zjlA-3w9hA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3w9i MULTIDRUG RESISTANCE
PROTEIN MEXB


(Pseudomonas
aeruginosa)
PF00873
(ACR_tran)
5 SER A  79
MET A 626
LEU A 827
THR A 859
GLY A 860
None
1.05A 4zjlA-3w9iA:
52.1
4zjlA-3w9iA:
69.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3zu4 PUTATIVE REDUCTASE
YPO4104/Y4119/YP_401
1


(Yersinia pestis)
PF07055
(Eno-Rase_FAD_bd)
PF12241
(Enoyl_reductase)
PF12242
(Eno-Rase_NADH_b)
5 SER A  86
SER A 280
GLU A  75
THR A  51
GLY A  52
None
None
NAI  A1400 (-3.7A)
NAI  A1400 ( 3.6A)
NAI  A1400 (-3.5A)
1.43A 4zjlA-3zu4A:
undetectable
4zjlA-3zu4A:
16.71
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.
4ar9 COLLAGENASE COLT

(Clostridium
tetani)
PF01752
(Peptidase_M9)
5 SER A 653
PHE A 467
GLU A 651
THR A 658
GLY A 725
None
1.38A 4zjlA-4ar9A:
3.4
4zjlA-4ar9A:
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.
4b3k BETA-GLUCOSIDASE

(Streptococcus
pyogenes)
PF00232
(Glyco_hydro_1)
5 SER A 314
PHE A 243
GLU A 171
LEU A 269
GLY A 186
None
1.29A 4zjlA-4b3kA:
undetectable
4zjlA-4b3kA:
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.
4dqn PUTATIVE
BRANCHED-CHAIN AMINO
ACID
AMINOTRANSFERASE
ILVE


(Streptococcus
mutans)
PF01063
(Aminotran_4)
5 PHE A 149
PHE A  57
LEU A 244
THR A 248
GLY A 284
None
1.49A 4zjlA-4dqnA:
undetectable
4zjlA-4dqnA:
15.94
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.
4fxq PUTATIVE
ADP-RIBOSYLTRANSFERA
SE CERTHRAX


(Bacillus cereus)
PF03496
(ADPrib_exo_Tox)
PF07737
(ATLF)
5 SER A 331
PHE A 440
LEU A 244
THR A 260
GLY A 257
None
1.34A 4zjlA-4fxqA:
undetectable
4zjlA-4fxqA:
17.32
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.
4jhz BETA-GLUCURONIDASE

(Escherichia
coli)
PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N)
5 SER A  50
SER A 329
LEU A 138
THR A  92
GLY A 110
None
1.32A 4zjlA-4jhzA:
undetectable
4zjlA-4jhzA:
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.
4jkl BETA-GLUCURONIDASE

(Streptococcus
agalactiae)
PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N)
5 SER A  43
SER A 328
LEU A 131
THR A  85
GLY A 103
None
1.33A 4zjlA-4jklA:
undetectable
4zjlA-4jklA:
21.57
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4mt1 DRUG EFFLUX PROTEIN

(Neisseria
gonorrhoeae)
PF00873
(ACR_tran)
5 SER A  79
MET A 570
PHE A 610
PHE A 612
GLY A 857
None
1.21A 4zjlA-4mt1A:
50.8
4zjlA-4mt1A:
49.20
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.
4o8m TRAP DICARBOXYLATE
TRANSPORTER, DCTP
SUBUNIT


(Actinobacillus
succinogenes)
PF03480
(DctP)
5 SER A 301
MET A  96
PHE A 310
GLU A 209
GLY A 186
None
1.41A 4zjlA-4o8mA:
undetectable
4zjlA-4o8mA:
16.84
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.
4q6g PYRROLYSINE--TRNA
LIGASE


(Methanosarcina
mazei)
PF01409
(tRNA-synt_2d)
5 PHE A 366
GLU A 261
GLU A 425
THR A 343
GLY A 326
None
1.34A 4zjlA-4q6gA:
1.6
4zjlA-4q6gA:
14.52
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.
4woq N-ACETYLNEURAMINATE
LYASE


(Clostridioides
difficile)
PF00701
(DHDPS)
5 SER A 158
PHE A 191
PHE A 176
THR A 153
GLY A 154
None
1.49A 4zjlA-4woqA:
undetectable
4zjlA-4woqA:
16.03
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.
4wsb POLYMERASE PB2

(Influenza A
virus)
PF00604
(Flu_PB2)
5 SER C 653
SER C 688
PHE C 600
PHE C 595
GLY C 727
None
1.44A 4zjlA-4wsbC:
undetectable
4zjlA-4wsbC:
22.58
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.
4xox 3-OXOACYL-ACP
SYNTHASE


(Vibrio cholerae)
PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C)
5 SER A 156
SER A 109
GLU A 190
THR A 163
GLY A 333
None
1.40A 4zjlA-4xoxA:
undetectable
4zjlA-4xoxA:
16.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4zz7 METHYLMALONATE-SEMIA
LDEHYDE
DEHYDROGENASE


(Oceanimonas
doudoroffii)
PF00171
(Aldedh)
5 SER A 284
PHE A 148
PHE A 150
GLY A 411
MET A 433
None
NAD  A 501 (-4.1A)
None
None
None
1.47A 4zjlA-4zz7A:
undetectable
4zjlA-4zz7A:
20.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5b7i CRISPR-ASSOCIATED
NUCLEASE/HELICASE
CAS3 SUBTYPE
I-F/YPEST


(Pseudomonas
aeruginosa)
no annotation 5 PHE A 973
GLU A 779
LEU A 772
THR A 459
GLY A 460
None
1.16A 4zjlA-5b7iA:
undetectable
4zjlA-5b7iA:
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.
5bop NANOBODY
OCTARELLIN V.1


(Lama glama;
synthetic
construct)
PF07686
(V-set)
no annotation
5 PHE A  37
GLU B 146
GLU B 119
LEU A 102
GLY B 141
None
1.27A 4zjlA-5bopA:
undetectable
4zjlA-5bopA:
9.42
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5eno MULTIDRUG EFFLUX
PUMP SUBUNIT
ACRB,MULTIDRUG
EFFLUX PUMP SUBUNIT
ACRB


(Escherichia
coli)
PF00873
(ACR_tran)
7 SER A  79
MET A 575
GLU A 683
LEU A 828
THR A 860
GLY A 861
MET A 862
None
0.86A 4zjlA-5enoA:
47.0
4zjlA-5enoA:
73.16
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5eno MULTIDRUG EFFLUX
PUMP SUBUNIT
ACRB,MULTIDRUG
EFFLUX PUMP SUBUNIT
ACRB


(Escherichia
coli)
PF00873
(ACR_tran)
6 SER A  79
SER A 133
GLU A 683
THR A 860
GLY A 861
MET A 862
None
1.08A 4zjlA-5enoA:
47.0
4zjlA-5enoA:
73.16
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5eno MULTIDRUG EFFLUX
PUMP SUBUNIT
ACRB,MULTIDRUG
EFFLUX PUMP SUBUNIT
ACRB


(Escherichia
coli)
PF00873
(ACR_tran)
9 SER A  79
SER A 135
MET A 573
PHE A 615
GLU A 683
LEU A 828
THR A 860
GLY A 861
MET A 862
None
0.80A 4zjlA-5enoA:
47.0
4zjlA-5enoA:
73.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ep8 PYRIMIDINE-NUCLEOSID
E PHOSPHORYLASE


(Bacillus
subtilis)
PF00591
(Glycos_transf_3)
PF02885
(Glycos_trans_3N)
PF07831
(PYNP_C)
5 SER A 347
GLU A 348
GLU A 211
THR A 202
GLY A 203
SER  A 347 ( 0.0A)
GLU  A 348 ( 0.6A)
GLU  A 211 ( 0.6A)
THR  A 202 ( 0.8A)
GLY  A 203 ( 0.0A)
1.45A 4zjlA-5ep8A:
undetectable
4zjlA-5ep8A:
18.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5fgn LIPOOLIGOSACCHARIDE
PHOSPHOETHANOLAMINE
TRANSFERASE A


(Neisseria
meningitidis)
PF00884
(Sulfatase)
PF08019
(DUF1705)
5 SER A 325
SER A 102
GLU A 298
GLU A 322
GLY A 329
LMT  A 602 (-3.3A)
None
None
None
None
1.46A 4zjlA-5fgnA:
undetectable
4zjlA-5fgnA:
20.62
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.
5fqd DNA DAMAGE-BINDING
PROTEIN 1


(Homo sapiens)
PF03178
(CPSF_A)
PF10433
(MMS1_N)
5 SER A1011
GLU A1002
LEU A 974
THR A1032
GLY A1031
None
1.40A 4zjlA-5fqdA:
undetectable
4zjlA-5fqdA:
23.79
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.
5hdj NFRA1

(Bacillus
megaterium)
PF00881
(Nitroreductase)
5 PHE A 159
PHE A  77
LEU A  22
GLY A 129
MET A 128
FMN  A 400 ( 4.6A)
None
None
None
None
1.33A 4zjlA-5hdjA:
undetectable
4zjlA-5hdjA:
12.77
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.
5ihr PROBABLE
BETA-GALACTOSIDASE A


(Aspergillus
niger)
PF01301
(Glyco_hydro_35)
PF10435
(BetaGal_dom2)
PF13363
(BetaGal_dom3)
PF13364
(BetaGal_dom4_5)
5 SER A 751
SER A 361
MET A 343
GLU A 803
GLY A 801
None
1.41A 4zjlA-5ihrA:
undetectable
4zjlA-5ihrA:
22.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5k04 UNCHARACTERIZED
PROTEIN
N-TERMINAL
ACETYLTRANSFERASE B
COMPLEX SUBUNIT NAT3


(Candida
albicans;
Candida
albicans)
PF09797
(NatB_MDM20)
PF08445
(FR47)
5 SER A 115
PHE A 128
PHE A 121
GLU A 117
GLU B  10
None
1.19A 4zjlA-5k04A:
undetectable
4zjlA-5k04A:
21.74
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.
5kni TANKYRASE-1

(Homo sapiens)
PF07647
(SAM_2)
5 SER A1037
MET A1029
PHE A1047
LEU A1065
GLY A1074
None
1.11A 4zjlA-5kniA:
undetectable
4zjlA-5kniA:
5.64
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.
5m42 PROLINE
DEHYDROGENASE


(Thermus
thermophilus)
PF01619
(Pro_dh)
5 PHE A 253
PHE A 224
LEU A 216
GLY A 243
MET A 242
None
1.23A 4zjlA-5m42A:
undetectable
4zjlA-5m42A:
14.22
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.
5n5n TUBULIN BETA CHAIN

(Homo sapiens)
no annotation 5 SER B 178
GLU B 183
GLU B  71
THR B 145
GLY B 144
None
None
None
G2P  B 501 (-3.2A)
G2P  B 501 ( 4.6A)
1.24A 4zjlA-5n5nB:
undetectable
4zjlA-5n5nB:
17.41
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.
5o7e COLH PROTEIN

(Hathewaya
histolytica)
no annotation 5 SER A 643
PHE A 435
GLU A 376
THR A 648
GLY A 715
None
1.28A 4zjlA-5o7eA:
2.4
4zjlA-5o7eA:
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.
5swi SUGAR HYDROLASE

(Streptococcus
pneumoniae)
no annotation 5 SER B 603
PHE B 317
PHE B 272
THR B  14
GLY B  13
None
1.48A 4zjlA-5swiB:
undetectable
4zjlA-5swiB:
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.
6d2l HISTONE-ARGININE
METHYLTRANSFERASE
CARM1


(Homo sapiens)
no annotation 5 PHE A 335
PHE A 422
LEU A 434
THR A 459
GLY A 460
None
1.33A 4zjlA-6d2lA:
undetectable
4zjlA-6d2lA:
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.
6em0 2-HYDROXYBIPHENYL-3-
MONOOXYGENASE


(Pseudomonas
nitroreducens)
no annotation 5 SER A 129
PHE A 140
GLU A 130
LEU A 118
THR A  54
None
1.47A 4zjlA-6em0A:
undetectable
4zjlA-6em0A:
undetectable