SIMILAR PATTERNS OF AMINO ACIDS FOR 1N4F_A_ASRA141_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.
12as ASPARAGINE
SYNTHETASE


(Escherichia
coli)
PF03590
(AsnA)
4 ASP A 220
GLY A 231
THR A 223
PRO A 224
None
0.87A 1n4fA-12asA:
undetectable
1n4fA-12asA:
17.33
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1di4 LYSOZYME C

(Homo sapiens)
PF00062
(Lys)
5 ASN A  66
ASP A  67
GLY A  68
THR A  70
PRO A  71
None
0.70A 1n4fA-1di4A:
25.1
1n4fA-1di4A:
60.47
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.
1ffv CUTL, MOLYBDOPROTEIN
OF CARBON MONOXIDE
DEHYDROGENASE


(Hydrogenophaga
pseudoflava)
PF01315
(Ald_Xan_dh_C)
PF02738
(Ald_Xan_dh_C2)
4 ASP B 679
GLY B 681
THR B 743
SER B 437
None
0.82A 1n4fA-1ffvB:
undetectable
1n4fA-1ffvB:
9.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ffv CUTL, MOLYBDOPROTEIN
OF CARBON MONOXIDE
DEHYDROGENASE


(Hydrogenophaga
pseudoflava)
PF01315
(Ald_Xan_dh_C)
PF02738
(Ald_Xan_dh_C2)
4 ASP B 679
THR B 743
PRO B 744
SER B 437
None
0.91A 1n4fA-1ffvB:
undetectable
1n4fA-1ffvB:
9.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1gso PROTEIN (GLYCINAMIDE
RIBONUCLEOTIDE
SYNTHETASE)


(Escherichia
coli)
PF01071
(GARS_A)
PF02843
(GARS_C)
PF02844
(GARS_N)
4 ASP A  82
GLY A  79
THR A  95
PRO A  94
None
0.97A 1n4fA-1gsoA:
undetectable
1n4fA-1gsoA:
14.42
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.
1icf PROTEIN (CATHEPSIN
L: HEAVY CHAIN)


(Homo sapiens)
PF00112
(Peptidase_C1)
4 ASN A 108
GLY A  81
PRO A 102
SER A 105
None
0.85A 1n4fA-1icfA:
undetectable
1n4fA-1icfA:
19.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1jbj CD3 EPSILON AND
GAMMA ECTODOMAIN
FRAGMENT COMPLEX


(Mus musculus)
PF16680
(Ig_4)
PF16681
(Ig_5)
4 ASN A  70
THR A  64
PRO A  65
SER A  67
None
0.95A 1n4fA-1jbjA:
undetectable
1n4fA-1jbjA:
23.12
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.
1jsw L-ASPARTATE
AMMONIA-LYASE


(Escherichia
coli)
PF00206
(Lyase_1)
PF10415
(FumaraseC_C)
4 GLY A 238
THR A 241
PRO A 242
SER A 246
None
0.84A 1n4fA-1jswA:
undetectable
1n4fA-1jswA:
12.92
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1jug LYSOZYME

(Tachyglossus
aculeatus)
PF00062
(Lys)
4 ASP A  66
GLY A  67
THR A  69
SER A  72
None
0.43A 1n4fA-1jugA:
23.2
1n4fA-1jugA:
52.76
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1jug LYSOZYME

(Tachyglossus
aculeatus)
PF00062
(Lys)
4 ASP A  66
THR A  69
PRO A  70
SER A  72
None
0.89A 1n4fA-1jugA:
23.2
1n4fA-1jugA:
52.76
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.
1k7j PROTEIN YCIO

(Escherichia
coli)
PF01300
(Sua5_yciO_yrdC)
4 GLY A 200
THR A 182
PRO A 181
SER A  36
None
0.83A 1n4fA-1k7jA:
undetectable
1n4fA-1k7jA:
20.39
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1lmo LYSOZYME

(Oncorhynchus
mykiss)
PF00062
(Lys)
4 ASP A  66
GLY A  67
THR A  69
PRO A  70
None
0.92A 1n4fA-1lmoA:
26.4
1n4fA-1lmoA:
60.47
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.
1n60 CARBON MONOXIDE
DEHYDROGENASE LARGE
CHAIN


(Oligotropha
carboxidovorans)
PF01315
(Ald_Xan_dh_C)
PF02738
(Ald_Xan_dh_C2)
4 ASP B 685
GLY B 687
THR B 749
SER B 440
None
0.77A 1n4fA-1n60B:
undetectable
1n4fA-1n60B:
9.45
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.
1n60 CARBON MONOXIDE
DEHYDROGENASE LARGE
CHAIN


(Oligotropha
carboxidovorans)
PF01315
(Ald_Xan_dh_C)
PF02738
(Ald_Xan_dh_C2)
4 ASP B 685
THR B 749
PRO B 750
SER B 440
None
0.87A 1n4fA-1n60B:
undetectable
1n4fA-1n60B:
9.45
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.
1s7m HIA

(Haemophilus
influenzae)
PF15403
(HiaBD2)
4 ASP A 633
GLY A 631
THR A 636
PRO A 637
None
0.99A 1n4fA-1s7mA:
undetectable
1n4fA-1s7mA:
23.12
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.
1urh 3-MERCAPTOPYRUVATE
SULFURTRANSFERASE


(Escherichia
coli)
PF00581
(Rhodanese)
4 ASP A 262
GLY A 263
PRO A  65
SER A  62
None
0.95A 1n4fA-1urhA:
undetectable
1n4fA-1urhA:
18.61
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.
1wn0 HISTIDINE-CONTAINING
PHOSPHOTRANSFER
PROTEIN


(Zea mays)
PF01627
(Hpt)
4 ASP A  36
GLY A  37
THR A  39
PRO A  40
None
0.77A 1n4fA-1wn0A:
undetectable
1n4fA-1wn0A:
21.95
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.
1xrs D-LYSINE
5,6-AMINOMUTASE BETA
SUBUNIT


(Acetoanaerobium
sticklandii)
PF02310
(B12-binding)
PF16554
(OAM_dimer)
4 ASP B 138
GLY B 136
THR B 134
SER B 127
None
B12  B 800 (-3.5A)
B12  B 800 (-4.2A)
None
0.89A 1n4fA-1xrsB:
undetectable
1n4fA-1xrsB:
18.36
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.
1yck PEPTIDOGLYCAN
RECOGNITION PROTEIN


(Homo sapiens)
PF01510
(Amidase_2)
4 ASN A  75
GLY A  94
PRO A 103
SER A 105
None
1.00A 1n4fA-1yckA:
undetectable
1n4fA-1yckA:
23.56
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.
1yq6 MINOR CAPSID PROTEIN

(Salmonella
virus PRD1)
PF08949
(DUF1860)
4 ASN A 322
ASP A 323
GLY A 271
PRO A 289
None
0.95A 1n4fA-1yq6A:
undetectable
1n4fA-1yq6A:
21.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1yz1 TRANSLATIONALLY
CONTROLLED TUMOR
PROTEIN


(Homo sapiens)
PF00838
(TCTP)
4 ASP A 154
GLY A 155
THR A 157
PRO A 158
None
0.71A 1n4fA-1yz1A:
undetectable
1n4fA-1yz1A:
19.65
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.
2a14 INDOLETHYLAMINE
N-METHYLTRANSFERASE


(Homo sapiens)
PF01234
(NNMT_PNMT_TEMT)
4 ASP A  28
GLY A  29
PRO A  31
SER A  32
None
0.92A 1n4fA-2a14A:
undetectable
1n4fA-2a14A:
20.65
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.
2cn3 BETA-1,4-XYLOGLUCAN
HYDROLASE


(Ruminiclostridium
thermocellum)
PF02012
(BNR)
4 GLY A 257
THR A 237
PRO A 236
SER A 231
None
0.95A 1n4fA-2cn3A:
undetectable
1n4fA-2cn3A:
11.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2d5l DIPEPTIDYL
AMINOPEPTIDASE IV,
PUTATIVE


(Porphyromonas
gingivalis)
PF00326
(Peptidase_S9)
PF00930
(DPPIV_N)
4 ASP A 490
GLY A 491
THR A 493
PRO A 494
None
0.84A 1n4fA-2d5lA:
undetectable
1n4fA-2d5lA:
11.32
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.
2epf PSEUDECIN

(Pseudechis
porphyriacus)
PF00188
(CAP)
PF08562
(Crisp)
4 GLY A  94
THR A 148
PRO A 149
SER A 145
None
0.97A 1n4fA-2epfA:
undetectable
1n4fA-2epfA:
21.50
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.
2g17 N-ACETYL-GAMMA-GLUTA
MYL-PHOSPHATE
REDUCTASE


(Salmonella
enterica)
PF01118
(Semialdhyde_dh)
PF02774
(Semialdhyde_dhC)
4 ASP A 307
GLY A 238
PRO A 236
SER A 187
None
0.94A 1n4fA-2g17A:
undetectable
1n4fA-2g17A:
15.16
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.
2gsn PHOSPHODIESTERASE-NU
CLEOTIDE
PYROPHOSPHATASE


(Xanthomonas
citri)
PF01663
(Phosphodiest)
4 GLY A  64
THR A  66
PRO A  67
SER A  70
None
0.47A 1n4fA-2gsnA:
undetectable
1n4fA-2gsnA:
15.62
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2gv0 LYSOZYME C

(Pelodiscus
sinensis)
PF00062
(Lys)
4 ASN A  67
ASP A  68
GLY A  69
THR A  71
None
0.21A 1n4fA-2gv0A:
25.9
1n4fA-2gv0A:
68.46
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2gv0 LYSOZYME C

(Pelodiscus
sinensis)
PF00062
(Lys)
4 ASN A  67
ASP A  68
THR A  71
PRO A  72
None
0.99A 1n4fA-2gv0A:
25.9
1n4fA-2gv0A:
68.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2igt SAM DEPENDENT
METHYLTRANSFERASE


(Agrobacterium
fabrum)
PF10672
(Methyltrans_SAM)
4 ASP A 290
GLY A 291
THR A 293
PRO A 294
None
0.73A 1n4fA-2igtA:
undetectable
1n4fA-2igtA:
15.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ip4 PHOSPHORIBOSYLAMINE-
-GLYCINE LIGASE


(Thermus
thermophilus)
PF01071
(GARS_A)
PF02843
(GARS_C)
PF02844
(GARS_N)
4 ASP A  79
GLY A  76
THR A  92
PRO A  91
None
0.93A 1n4fA-2ip4A:
undetectable
1n4fA-2ip4A:
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.
2jfd FATTY ACID SYNTHASE

(Homo sapiens)
PF00698
(Acyl_transf_1)
PF16197
(KAsynt_C_assoc)
4 ASP A 591
GLY A 592
PRO A 707
SER A 730
None
0.85A 1n4fA-2jfdA:
undetectable
1n4fA-2jfdA:
14.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2nnz HYPOTHETICAL PROTEIN

(Archaeoglobus
fulgidus)
PF04126
(Cyclophil_like)
4 GLY A  49
THR A  91
PRO A  92
SER A  94
None
0.79A 1n4fA-2nnzA:
undetectable
1n4fA-2nnzA:
20.45
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.
2pxx UNCHARACTERIZED
PROTEIN MGC2408


(Homo sapiens)
PF08241
(Methyltransf_11)
4 ASP A 134
GLY A 131
THR A 175
SER A 173
None
SAH  A 301 (-4.1A)
None
None
0.93A 1n4fA-2pxxA:
undetectable
1n4fA-2pxxA:
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.
2q9g CYTOCHROME P450 46A1

(Homo sapiens)
PF00067
(p450)
4 ASP A 173
GLY A 174
THR A 176
PRO A 177
None
0.76A 1n4fA-2q9gA:
undetectable
1n4fA-2q9gA:
13.72
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.
2qq6 MANDELATE
RACEMASE/MUCONATE
LACTONIZING
ENZYME-LIKE PROTEIN


(Rubrobacter
xylanophilus)
PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C)
4 GLY A 235
THR A 260
PRO A 261
SER A 259
None
0.99A 1n4fA-2qq6A:
undetectable
1n4fA-2qq6A:
15.45
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.
2rgn RHO GUANINE
NUCLEOTIDE EXCHANGE
FACTOR 25


(Homo sapiens)
PF00621
(RhoGEF)
4 ASN B 422
ASP B 426
PRO B 451
SER B 454
None
0.90A 1n4fA-2rgnB:
undetectable
1n4fA-2rgnB:
15.41
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.
2uzf NAPHTHOATE SYNTHASE

(Staphylococcus
aureus)
PF00378
(ECH_1)
4 ASP A  76
GLY A  75
THR A  38
PRO A  39
None
CAA  A1274 (-3.1A)
None
None
0.96A 1n4fA-2uzfA:
undetectable
1n4fA-2uzfA:
19.09
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.
2v3b RUBREDOXIN REDUCTASE

(Pseudomonas
aeruginosa)
PF07992
(Pyr_redox_2)
4 ASP A  27
GLY A  28
THR A  30
PRO A  31
None
0.95A 1n4fA-2v3bA:
undetectable
1n4fA-2v3bA:
15.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2w2j CARBONIC
ANHYDRASE-RELATED
PROTEIN


(Homo sapiens)
PF00194
(Carb_anhydrase)
4 ASN A  84
ASP A  85
GLY A  86
THR A  88
None
0.67A 1n4fA-2w2jA:
undetectable
1n4fA-2w2jA:
18.15
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2z2f LYSOZYME C-2

(Bos taurus)
PF00062
(Lys)
4 ASP A  67
GLY A  68
THR A  70
PRO A  71
None
0.83A 1n4fA-2z2fA:
25.8
1n4fA-2z2fA:
54.62
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.
3aup BASIC 7S GLOBULIN

(Glycine max)
PF14541
(TAXi_C)
PF14543
(TAXi_N)
4 ASN A  16
ASP A  17
GLY A  18
THR A  20
None
0.79A 1n4fA-3aupA:
undetectable
1n4fA-3aupA:
18.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ctt MALTASE-GLUCOAMYLASE

(Homo sapiens)
PF00088
(Trefoil)
PF01055
(Glyco_hydro_31)
PF16863
(NtCtMGAM_N)
4 ASP A 396
GLY A 397
THR A 399
PRO A 400
None
NAG  A2002 (-4.7A)
None
None
0.88A 1n4fA-3cttA:
undetectable
1n4fA-3cttA:
9.92
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.
3g1b ATP-DEPENDENT CLP
PROTEASE ADAPTER
PROTEIN CLPS


(Caulobacter
vibrioides)
PF02617
(ClpS)
4 ASN A  47
ASP A  48
THR A  51
PRO A  52
None
0.83A 1n4fA-3g1bA:
undetectable
1n4fA-3g1bA:
15.75
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.
3lpp SUCRASE-ISOMALTASE

(Homo sapiens)
PF00088
(Trefoil)
PF01055
(Glyco_hydro_31)
PF16863
(NtCtMGAM_N)
4 ASP A 425
GLY A 426
THR A 428
PRO A 429
None
NAG  A3001 (-4.2A)
None
None
0.84A 1n4fA-3lppA:
undetectable
1n4fA-3lppA:
8.84
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.
3mjf PHOSPHORIBOSYLAMINE-
-GLYCINE LIGASE


(Yersinia pestis)
PF01071
(GARS_A)
PF02843
(GARS_C)
PF02844
(GARS_N)
4 ASP A  82
GLY A  79
THR A  95
PRO A  94
None
0.99A 1n4fA-3mjfA:
undetectable
1n4fA-3mjfA:
14.79
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.
3nz4 PHENYLALANINE
AMMONIA-LYASE


(Taxus
canadensis)
PF00221
(Lyase_aromatic)
4 ASP A  30
GLY A  31
THR A  33
PRO A  34
None
0.74A 1n4fA-3nz4A:
undetectable
1n4fA-3nz4A:
11.09
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.
3o1f ATP-DEPENDENT CLP
PROTEASE ADAPTER
PROTEIN CLPS


(Escherichia
coli)
PF02617
(ClpS)
4 ASN B  34
ASP B  35
THR B  38
PRO B  39
None
0.96A 1n4fA-3o1fB:
undetectable
1n4fA-3o1fB:
18.32
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.
3o2h ATP-DEPENDENT CLP
PROTEASE ADAPTOR
PROTEIN CLPS


(Escherichia
coli)
PF02617
(ClpS)
4 ASN A  34
ASP A  35
THR A  38
PRO A  39
None
0.87A 1n4fA-3o2hA:
undetectable
1n4fA-3o2hA:
18.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3r1x 2-OXO-3-DEOXYGALACTO
NATE KINASE


(Klebsiella
pneumoniae)
PF05035
(DGOK)
4 ASP A  56
GLY A  57
THR A  59
PRO A  60
None
0.71A 1n4fA-3r1xA:
undetectable
1n4fA-3r1xA:
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.
3sze SERINE PROTEASE ESPP

(Escherichia
coli)
PF02395
(Peptidase_S6)
4 ASN A 128
GLY A 264
THR A 114
SER A 134
None
0.85A 1n4fA-3szeA:
undetectable
1n4fA-3szeA:
8.55
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.
3utn THIOSULFATE
SULFURTRANSFERASE
TUM1


(Saccharomyces
cerevisiae)
PF00581
(Rhodanese)
4 ASP X 284
GLY X 285
PRO X  69
SER X  66
None
0.68A 1n4fA-3utnX:
undetectable
1n4fA-3utnX:
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.
3v39 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE


(Bdellovibrio
bacteriovorus)
PF02113
(Peptidase_S13)
4 ASN A 292
GLY A 159
THR A 161
PRO A 162
TAU  A 501 (-3.7A)
None
None
None
0.85A 1n4fA-3v39A:
undetectable
1n4fA-3v39A:
15.61
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.
3vzi CRISPR-ASSOCIATED
PROTEIN CAS5, DVULG
SUBTYPE


(Xanthomonas
oryzae)
PF09704
(Cas_Cas5d)
4 ASP A 196
GLY A 197
THR A 199
PRO A 200
None
0.82A 1n4fA-3vziA:
undetectable
1n4fA-3vziA:
20.34
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3zvq LYSOZYME C
LYSOZYME C


(Gallus gallus;
Gallus gallus)
PF00062
(Lys)
PF00062
(Lys)
6 ASN A  65
ASP A  66
GLY A  67
THR A  69
PRO A  70
SER B  72
None
0.75A 1n4fA-3zvqA:
10.7
1n4fA-3zvqA:
100.00
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.
4aq4 SN-GLYCEROL-3-PHOSPH
ATE-BINDING
PERIPLASMIC PROTEIN
UGPB


(Escherichia
coli)
PF13416
(SBP_bac_8)
4 GLY A 283
THR A 122
PRO A 123
SER A 248
G3P  A1415 (-3.0A)
None
None
None
0.72A 1n4fA-4aq4A:
undetectable
1n4fA-4aq4A:
16.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4gi2 CROTONYL-COA
CARBOXYLASE/REDUCTAS
E


(Methylobacterium
extorquens)
PF00107
(ADH_zinc_N)
PF08240
(ADH_N)
4 GLY A 311
THR A 314
PRO A 316
SER A 318
None
0.90A 1n4fA-4gi2A:
undetectable
1n4fA-4gi2A:
15.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4km3 METHIONINE
AMINOPEPTIDASE


(Streptococcus
pneumoniae)
PF00557
(Peptidase_M24)
4 ASP A  91
GLY A  92
THR A 145
PRO A 146
None
0.95A 1n4fA-4km3A:
undetectable
1n4fA-4km3A:
18.35
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.
4nsy LYSYL ENDOPEPTIDASE

(Lysobacter
enzymogenes)
PF13365
(Trypsin_2)
4 ASP A 225
GLY A 212
PRO A 191
SER A 194
2OY  A 301 (-2.2A)
2OY  A 301 (-4.0A)
2OY  A 301 (-3.0A)
2OY  A 301 (-1.4A)
1.00A 1n4fA-4nsyA:
undetectable
1n4fA-4nsyA:
20.08
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.
4q48 DNA HELICASE RECQ

(Deinococcus
radiodurans)
PF00270
(DEAD)
PF00271
(Helicase_C)
PF09382
(RQC)
PF16124
(RecQ_Zn_bind)
4 ASP A 330
GLY A 331
PRO A 333
SER A 334
None
0.79A 1n4fA-4q48A:
undetectable
1n4fA-4q48A:
13.99
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.
4q80 SERINE PROTEASE 57

(Homo sapiens)
PF00089
(Trypsin)
5 ASP A 222
GLY A 221
THR A 224
PRO A 225
SER A 216
None
None
None
None
2YS  A 304 (-3.7A)
1.28A 1n4fA-4q80A:
undetectable
1n4fA-4q80A:
20.63
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.
4qd9 THIOESTERASE PA1618

(Pseudomonas
aeruginosa)
PF03061
(4HBT)
4 ASP A 124
GLY A 125
PRO A 127
SER A 128
None
0.99A 1n4fA-4qd9A:
undetectable
1n4fA-4qd9A:
22.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4quk DIHYDROFLAVONOL-4-RE
DUCTASE


(Medicago
truncatula)
PF01370
(Epimerase)
4 ASP A 233
THR A 305
PRO A 306
SER A 310
None
0.80A 1n4fA-4qukA:
undetectable
1n4fA-4qukA:
15.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4u48 PUTATIVE INNER
MEMBRANE LIPOPROTEIN


(Salmonella
enterica)
PF00207
(A2M)
PF01835
(A2M_N)
PF07703
(A2M_N_2)
PF10569
(Thiol-ester_cl)
PF11974
(MG1)
4 GLY A1545
THR A1611
PRO A1612
SER A1029
None
0.96A 1n4fA-4u48A:
undetectable
1n4fA-4u48A:
5.57
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4wg1 LYSOZYME C

(Gallus gallus)
PF00062
(Lys)
6 ASN A  65
ASP A  66
GLY A  67
THR A  69
PRO A  70
SER A  72
None
0.42A 1n4fA-4wg1A:
28.4
1n4fA-4wg1A:
100.00
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.
4yg3 OUTER CAPSID PROTEIN
VP4


(Rotavirus A)
no annotation 4 ASN A  79
ASP A 169
GLY A 170
PRO A 196
None
0.89A 1n4fA-4yg3A:
undetectable
1n4fA-4yg3A:
23.70
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.
4yjx ATP-DEPENDENT CLP
PROTEASE ADAPTER
PROTEIN CLPS 2


(Agrobacterium
fabrum)
PF02617
(ClpS)
4 ASN A  30
ASP A  31
THR A  34
PRO A  35
NFA  A 202 (-2.8A)
NFA  A 202 (-3.3A)
NFA  A 202 (-4.1A)
NFA  A 202 ( 4.1A)
0.95A 1n4fA-4yjxA:
undetectable
1n4fA-4yjxA:
21.95
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.
4z2a FURIN

(Homo sapiens)
PF00082
(Peptidase_S8)
PF01483
(P_proprotein)
4 ASP A 306
GLY A 307
THR A 309
SER A 335
None
0.76A 1n4fA-4z2aA:
undetectable
1n4fA-4z2aA:
16.79
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.
5b0u OPLOPHORUS-LUCIFERIN
2-MONOOXYGENASE
CATALYTIC SUBUNIT


(Oplophorus
gracilirostris)
no annotation 4 ASP A 100
GLY A 101
THR A 103
PRO A 104
None
0.67A 1n4fA-5b0uA:
undetectable
1n4fA-5b0uA:
21.43
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.
5bnz GLUTAMINE--TRNA
LIGASE


(Pseudomonas
aeruginosa)
PF00749
(tRNA-synt_1c)
PF03950
(tRNA-synt_1c_C)
4 GLY A 302
THR A 304
PRO A 305
SER A 307
None
0.95A 1n4fA-5bnzA:
undetectable
1n4fA-5bnzA:
13.89
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.
5bwd BENZYLSUCCINATE
SYNTHASE ALPHA CHAIN


(Thauera
aromatica)
PF01228
(Gly_radical)
PF02901
(PFL-like)
4 ASP A 724
GLY A 725
THR A 722
PRO A 721
None
0.99A 1n4fA-5bwdA:
undetectable
1n4fA-5bwdA:
10.62
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.
5c92 KELCH
DOMAIN-CONTAINING
PROTEIN


(Colletotrichum
graminicola)
PF01344
(Kelch_1)
PF09118
(DUF1929)
4 ASP A 377
GLY A 378
THR A 380
PRO A 381
None
0.73A 1n4fA-5c92A:
undetectable
1n4fA-5c92A:
13.07
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.
5cer BD0816

(Bdellovibrio
bacteriovorus)
PF02113
(Peptidase_S13)
4 ASN A 280
GLY A 147
THR A 149
PRO A 150
None
0.87A 1n4fA-5cerA:
undetectable
1n4fA-5cerA:
17.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5dwf PEPTIDOGLYCAN
RECOGNITION PROTEIN
1


(Camelus
dromedarius)
PF01510
(Amidase_2)
4 ASP A  44
THR A  45
PRO A  46
SER A  48
None
0.95A 1n4fA-5dwfA:
undetectable
1n4fA-5dwfA:
26.47
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.
5dxx ARTEMISINIC ALDEHYDE
DELTA(11(13))
REDUCTASE


(Artemisia annua)
PF00724
(Oxidored_FMN)
4 ASN A 196
ASP A 197
THR A 124
PRO A 149
None
0.91A 1n4fA-5dxxA:
undetectable
1n4fA-5dxxA:
16.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5e7s LON PROTEASE

(Meiothermus
taiwanensis)
PF05362
(Lon_C)
4 ASP A 669
GLY A 670
THR A 672
PRO A 673
None
0.81A 1n4fA-5e7sA:
undetectable
1n4fA-5e7sA:
18.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5fu4 CBM74-RFGH5

(Ruminococcus
flavefaciens)
no annotation 4 ASP A 494
THR A 436
PRO A 437
SER A 439
None
0.86A 1n4fA-5fu4A:
undetectable
1n4fA-5fu4A:
24.06
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.
5i5j NITROUS-OXIDE
REDUCTASE


(Shewanella
denitrificans)
no annotation 4 ASN A 461
ASP A 462
GLY A 478
THR A 480
None
0.81A 1n4fA-5i5jA:
undetectable
1n4fA-5i5jA:
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.
5ibo OPLOPHORUS-LUCIFERIN
2-MONOOXYGENASE
CATALYTIC SUBUNIT


(Oplophorus
gracilirostris)
no annotation 4 ASP A 100
GLY A 101
THR A 103
PRO A 104
None
0.69A 1n4fA-5iboA:
undetectable
1n4fA-5iboA:
20.88
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.
5ikl GERANYL-COA
CARBOXYLASE,
BETA-SUBUNIT


(Pseudomonas
aeruginosa)
PF01039
(Carboxyl_trans)
4 ASN B 321
ASP B 324
GLY B 325
THR B 327
None
0.93A 1n4fA-5iklB:
undetectable
1n4fA-5iklB:
13.31
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5jen LYSOZYME C

(Gallus gallus)
PF00062
(Lys)
6 ASN B  65
ASP B  66
GLY B  67
THR B  69
PRO B  70
SER B  72
None
None
CL  B 201 (-3.6A)
None
None
NA  B 200 (-2.4A)
0.41A 1n4fA-5jenB:
26.6
1n4fA-5jenB:
100.00
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.
5jm0 ALPHA-MANNOSIDASE,AL
PHA-MANNOSIDASE,ALPH
A-MANNOSIDASE


(Saccharomyces
cerevisiae)
PF01074
(Glyco_hydro_38)
PF07748
(Glyco_hydro_38C)
PF09261
(Alpha-mann_mid)
4 ASN A 296
GLY A 499
THR A 508
PRO A 507
None
0.98A 1n4fA-5jm0A:
undetectable
1n4fA-5jm0A:
8.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5lb3 ATP-DEPENDENT DNA
HELICASE Q5


(Homo sapiens)
PF00270
(DEAD)
PF00271
(Helicase_C)
PF16124
(RecQ_Zn_bind)
4 ASP B 353
GLY B 354
PRO B 356
SER B 357
None
0.78A 1n4fA-5lb3B:
undetectable
1n4fA-5lb3B:
15.59
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.
5m8t 5,6-DIHYDROXYINDOLE-
2-CARBOXYLIC ACID
OXIDASE


(Homo sapiens)
PF00264
(Tyrosinase)
4 ASP A 173
GLY A 174
THR A 176
PRO A 177
None
0.36A 1n4fA-5m8tA:
undetectable
1n4fA-5m8tA:
13.70
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.
5ngw OPGH99A

(Ochrovirga
pacifica)
no annotation 4 ASP A 349
GLY A 350
THR A 352
PRO A 353
None
0.80A 1n4fA-5ngwA:
undetectable
1n4fA-5ngwA:
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.
5o0s GLUCOSYLCERAMIDASE

(Thermoanaerobacterium
xylanolyticum)
PF04685
(DUF608)
PF12215
(Glyco_hydr_116N)
PF17168
(DUF5127)
4 ASN A 578
ASP A 579
GLY A 580
PRO A 582
None
CA  A 910 (-2.8A)
None
None
0.92A 1n4fA-5o0sA:
undetectable
1n4fA-5o0sA:
9.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ogx CYTOCHROME P450
REDUCTASE


(Amycolatopsis
methanolica)
no annotation 4 ASP A 204
GLY A 205
PRO A 207
SER A 298
None
1.00A 1n4fA-5ogxA:
undetectable
1n4fA-5ogxA:
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.
5u4n FRUCTOSE-1

(Neisseria
gonorrhoeae)
PF01116
(F_bP_aldolase)
4 ASP A 111
GLY A 112
THR A 114
PRO A 115
None
0.70A 1n4fA-5u4nA:
undetectable
1n4fA-5u4nA:
14.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5u7s FRUCTOSE-1,6-BISPHOS
PHATE ALDOLASE


(Acinetobacter
baumannii)
PF01116
(F_bP_aldolase)
4 ASP A 111
GLY A 109
THR A 114
PRO A 115
None
0.89A 1n4fA-5u7sA:
undetectable
1n4fA-5u7sA:
15.76
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.
5u7s FRUCTOSE-1,6-BISPHOS
PHATE ALDOLASE


(Acinetobacter
baumannii)
PF01116
(F_bP_aldolase)
4 ASP A 111
GLY A 112
THR A 114
PRO A 115
None
0.77A 1n4fA-5u7sA:
undetectable
1n4fA-5u7sA:
15.76
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5v8g LYSOZYME ISOFORM I

(Anas
platyrhynchos)
no annotation 5 ASP A  66
GLY A  67
THR A  69
PRO A  70
SER A  72
None
0.66A 1n4fA-5v8gA:
27.1
1n4fA-5v8gA:
84.25
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.
5v91 FOSFOMYCIN
RESISTANCE PROTEIN


(Klebsiella
pneumoniae)
PF00903
(Glyoxalase)
4 GLY A 109
THR A  58
PRO A  59
SER A  63
None
0.95A 1n4fA-5v91A:
undetectable
1n4fA-5v91A:
14.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5vb0 FOSFOMYCIN
RESISTANCE PROTEIN
FOSA3


(Escherichia
coli)
PF00903
(Glyoxalase)
4 GLY A 109
THR A  58
PRO A  59
SER A  63
None
0.87A 1n4fA-5vb0A:
undetectable
1n4fA-5vb0A:
16.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5w7p OXAC

(Penicillium
oxalicum)
no annotation 4 GLY A  90
THR A 133
PRO A 134
SER A 136
None
0.81A 1n4fA-5w7pA:
undetectable
1n4fA-5w7pA:
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.
5wsz LPMO10A

(Bacillus
thuringiensis)
PF03067
(LPMO_10)
4 ASN A 119
ASP A 120
GLY A 121
THR A  87
None
0.98A 1n4fA-5wszA:
undetectable
1n4fA-5wszA:
17.75
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.
5xkl ESX-3
SECRETION-ASSOCIATED
PROTEIN ESPG3


(Mycobacterium
tuberculosis)
no annotation 4 GLY A 170
THR A 167
PRO A 166
SER A 254
None
0.85A 1n4fA-5xklA:
undetectable
1n4fA-5xklA:
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.
5yp3 DIPEPTIDYL
AMINOPEPTIDASE 4


(Pseudoxanthomonas
mexicana)
no annotation 4 ASP A 499
GLY A 500
THR A 502
PRO A 503
None
0.77A 1n4fA-5yp3A:
undetectable
1n4fA-5yp3A:
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.
6ch0 -

(-)
no annotation 4 ASP C 162
GLY C 125
PRO C  70
SER C  72
None
0.93A 1n4fA-6ch0C:
undetectable
1n4fA-6ch0C:
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.
6ffl MALTOSE/MALTODEXTRIN
TRANSPORT PERMEASE
HOMOLOGUE


(Bdellovibrio
bacteriovorus)
no annotation 4 ASP A 182
GLY A 183
THR A 185
PRO A 186
None
0.68A 1n4fA-6fflA:
undetectable
1n4fA-6fflA:
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.
6fos PHOTOSYSTEM I
REACTION CENTER
SUBUNIT II


(Cyanidioschyzon
merolae)
no annotation 4 GLY F  88
THR F  32
PRO F  33
SER F  37
None
0.89A 1n4fA-6fosF:
undetectable
1n4fA-6fosF:
undetectable