SIMILAR PATTERNS OF AMINO ACIDS FOR 3IB0_A_DIFA701_1

List of similar pattern of amino acids derived from ASSAM search

Hit pattern: 3D amino acid arrangements similar to known drug binding site
Query pattern: Residues from known binding site for annotated drug that match the hit pattern

(Click link on the last column to view superposed patterns of amino acids in NGL viewer)
(Note that only 3-12 residue patterns can be used for ASSAM searches)
Filter list by:
Hit Macromolecule/
Organism		 Pfam Res. Interface HETATM RMSD Dali Z-score Seq. Identity (%) View Dock
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1biy LACTOFERRIN

(Bubalus bubalis) 		PF00405
(Transferrin) 		4 PRO A 593
TYR A 660
GLY A 662
THR A 663
 None
 0.29A 3ib0A-1biyA:
55.3		 3ib0A-1biyA:
91.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1bpl ALPHA-1,4-GLUCAN-4-G
LUCANOHYDROLASE

(Bacillus
licheniformis) 		PF00128
(Alpha-amylase) 		4 PRO A  44
TYR A  56
GLY A  57
THR A  49
 None
 1.50A 3ib0A-1bplA:
undetectable		 3ib0A-1bplA:
17.87
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.
1gkp HYDANTOINASE

(Thermus sp.) 		PF01979
(Amidohydro_1) 		4 PRO A 397
TYR A  50
GLY A  48
THR A  47
 None
 1.39A 3ib0A-1gkpA:
0.0		 3ib0A-1gkpA:
21.52
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.
1gz4 NAD-DEPENDENT MALIC
ENZYME

(Homo sapiens) 		PF00390
(malic)
PF03949
(Malic_M) 		4 PRO A 195
TYR A  97
GLY A 192
THR A 557
 None
 1.15A 3ib0A-1gz4A:
0.7		 3ib0A-1gz4A:
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.
1h14 ENDO-1,4-BETA-XYLANA
SE

(Pseudoalteromonas
haloplanktis) 		PF01270
(Glyco_hydro_8) 		4 PRO A  69
TYR A 378
GLY A 376
THR A 375
 None
 1.43A 3ib0A-1h14A:
0.0		 3ib0A-1h14A:
19.52
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.
1hju BETA-1,4-GALACTANASE

(Thermothelomyces
thermophila) 		PF07745
(Glyco_hydro_53) 		4 PRO A 298
TYR A 295
GLY A   6
THR A  43
 None
 1.44A 3ib0A-1hjuA:
0.0		 3ib0A-1hjuA:
21.98
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.
1i71 APOLIPOPROTEIN(A)

(Homo sapiens) 		PF00051
(Kringle) 		4 PRO A  53
TYR A  40
GLY A  44
THR A  46
 None
 1.43A 3ib0A-1i71A:
undetectable		 3ib0A-1i71A:
11.14
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.
1iiw SLR1257 PROTEIN

(Synechocystis
sp. PCC 6803) 		PF00497
(SBP_bac_3) 		4 PRO A 189
TYR A 190
GLY A 191
THR A  88
 None
 1.50A 3ib0A-1iiwA:
7.8		 3ib0A-1iiwA:
26.62
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.
1l0w ASPARTYL-TRNA
SYNTHETASE

(Thermus
thermophilus) 		PF00152
(tRNA-synt_2)
PF01336
(tRNA_anti-codon)
PF02938
(GAD) 		4 PRO A 291
TYR A 286
GLY A 287
THR A 398
 None
 1.36A 3ib0A-1l0wA:
undetectable		 3ib0A-1l0wA:
20.14
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.
1pc3 PHOSPHATE-BINDING
PROTEIN 1

(Mycobacterium
tuberculosis) 		PF12849
(PBP_like_2) 		4 PRO A 159
TYR A 131
GLY A 133
THR A 134
 None
 1.39A 3ib0A-1pc3A:
5.5		 3ib0A-1pc3A:
20.43
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.
1qub PROTEIN (HUMAN
BETA2-GLYCOPROTEIN
I)

(Homo sapiens) 		PF00084
(Sushi)
PF09014
(Sushi_2) 		4 PRO A 120
TYR A  96
GLY A  94
THR A  93
 None
 1.37A 3ib0A-1qubA:
undetectable		 3ib0A-1qubA:
24.14
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.
1rc9 CYSTEINE-RICH
SECRETORY PROTEIN

(Trimeresurus
stejnegeri) 		PF00188
(CAP)
PF08562
(Crisp) 		4 PRO A  31
TYR A 161
GLY A 164
THR A 165
 None
 1.45A 3ib0A-1rc9A:
undetectable		 3ib0A-1rc9A:
17.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1sb3 4-HYDROXYBENZOYL-COA
REDUCTASE ALPHA
SUBUNIT

(Thauera
aromatica) 		PF01315
(Ald_Xan_dh_C)
PF02738
(Ald_Xan_dh_C2) 		4 PRO A  92
TYR A  91
GLY A  74
THR A  73
 None
 1.46A 3ib0A-1sb3A:
undetectable		 3ib0A-1sb3A:
19.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1uqw PUTATIVE BINDING
PROTEIN YLIB

(Escherichia
coli) 		PF00496
(SBP_bac_5) 		4 PRO A 190
TYR A 165
GLY A 163
THR A 162
 None
 1.00A 3ib0A-1uqwA:
4.2		 3ib0A-1uqwA:
21.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1x55 ASPARAGINYL-TRNA
SYNTHETASE

(Pyrococcus
horikoshii) 		PF00152
(tRNA-synt_2)
PF01336
(tRNA_anti-codon) 		4 PRO A 129
TYR A  26
GLY A  44
THR A  43
 None
 1.34A 3ib0A-1x55A:
undetectable		 3ib0A-1x55A:
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.
2b24 NAPHTHALENE
DIOXYGENASE LARGE
SUBUNIT

(Rhodococcus sp.
NCIMB 12038) 		PF00355
(Rieske)
PF00848
(Ring_hydroxyl_A) 		4 PRO A 257
TYR A 239
GLY A 255
THR A 291
 None
 1.18A 3ib0A-2b24A:
undetectable		 3ib0A-2b24A:
22.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ckr ENDOGLUCANASE E-5

(Thermobifida
fusca) 		PF00150
(Cellulase) 		4 PRO A 232
TYR A 275
GLY A 295
THR A 296
 None
 1.46A 3ib0A-2ckrA:
undetectable		 3ib0A-2ckrA:
21.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2d7t ANTI
POLYHYDROXYBUTYRATE
ANTIBODY FV, HEAVY
CHAIN

(Homo sapiens) 		PF07686
(V-set) 		4 PRO H  53
TYR H  33
GLY H  31
THR H  28
 None
 1.46A 3ib0A-2d7tH:
undetectable		 3ib0A-2d7tH:
15.52
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.
2e6i TYROSINE-PROTEIN
KINASE ITK/TSK

(Homo sapiens) 		PF00779
(BTK) 		4 PRO A  17
TYR A  15
GLY A  37
THR A  36
 None
 1.22A 3ib0A-2e6iA:
undetectable		 3ib0A-2e6iA:
12.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2e7t BASIC AGGLUTININ

(Psophocarpus
tetragonolobus) 		PF00139
(Lectin_legB) 		4 PRO A 112
TYR A 106
GLY A 101
THR A 100
 None
A2G  A 400 ( 4.7A)
None
None
 0.92A 3ib0A-2e7tA:
undetectable		 3ib0A-2e7tA:
21.61
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.
2e7t BASIC AGGLUTININ

(Psophocarpus
tetragonolobus) 		PF00139
(Lectin_legB) 		4 PRO A 112
TYR A 110
GLY A 101
THR A 100
 None
 1.11A 3ib0A-2e7tA:
undetectable		 3ib0A-2e7tA:
21.61
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.
2fx5 LIPASE

(Pseudomonas
mendocina) 		no annotation 4 PRO A 107
TYR A 108
GLY A 109
THR A 110
 None
 1.24A 3ib0A-2fx5A:
undetectable		 3ib0A-2fx5A:
20.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2gzq PHOSPHATIDYLETHANOLA
MINE-BINDING PROTEIN

(Plasmodium
vivax) 		PF01161
(PBP) 		4 PRO A  56
TYR A 118
GLY A 107
THR A 108
 None
 0.97A 3ib0A-2gzqA:
undetectable		 3ib0A-2gzqA:
20.53
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.
2joz HYPOTHETICAL PROTEIN
YXEF

(Bacillus
subtilis) 		PF11631
(DUF3255) 		4 PRO A  15
TYR A  17
GLY A  19
THR A  20
 None
 1.49A 3ib0A-2jozA:
undetectable		 3ib0A-2jozA:
14.94
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.
2mmb UNCHARACTERIZED
PROTEIN

(Acinetobacter
baumannii) 		PF16309
(DUF4951) 		4 PRO A  91
TYR A  95
GLY A  44
THR A  43
 None
 1.42A 3ib0A-2mmbA:
undetectable		 3ib0A-2mmbA:
15.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2pk4 HUMAN PLASMINOGEN
KRINGLE 4

(Homo sapiens) 		PF00051
(Kringle) 		4 PRO A  54
TYR A  41
GLY A  45
THR A  47
 None
 1.44A 3ib0A-2pk4A:
undetectable		 3ib0A-2pk4A:
12.28
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.
2r5j MAJOR CAPSID PROTEIN
L1

(Alphapapillomavirus
9) 		PF00500
(Late_protein_L1) 		4 PRO A 308
TYR A 309
GLY A 104
THR A 103
 None
 1.29A 3ib0A-2r5jA:
undetectable		 3ib0A-2r5jA:
21.56
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.
2r5k MAJOR CAPSID PROTEIN
L1

(Alphapapillomavirus
10) 		PF00500
(Late_protein_L1) 		4 PRO A 307
TYR A 308
GLY A 101
THR A 100
 None
 1.35A 3ib0A-2r5kA:
undetectable		 3ib0A-2r5kA:
19.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2z1q ACYL-COA
DEHYDROGENASE

(Thermus
thermophilus) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N) 		4 PRO A 337
TYR A 123
GLY A 125
THR A 126
 None
 1.31A 3ib0A-2z1qA:
undetectable		 3ib0A-2z1qA:
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.
3bwq CAPSID PROTEIN VP1

(Macaca mulatta
polyomavirus 1) 		PF00718
(Polyoma_coat) 		4 PRO A 210
TYR A 220
GLY A 222
THR A 223
 None
 1.44A 3ib0A-3bwqA:
undetectable		 3ib0A-3bwqA:
23.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3dzt D7 PROTEIN

(Aedes aegypti) 		PF01395
(PBP_GOBP) 		4 PRO A  63
TYR A  61
GLY A  59
THR A  58
 None
None
None
EAH  A 305 ( 4.0A)
 1.42A 3ib0A-3dztA:
undetectable		 3ib0A-3dztA:
21.07
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.
3e60 3-OXOACYL-[ACYL-CARR
IER-PROTEIN ]
SYNTHASE II

(Bartonella
henselae) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		4 PRO A 280
TYR A 275
GLY A 408
THR A 409
 None
 1.26A 3ib0A-3e60A:
undetectable		 3ib0A-3e60A:
21.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3fah ALDEHYDE
OXIDOREDUCTASE

(Desulfovibrio
gigas) 		PF00111
(Fer2)
PF01315
(Ald_Xan_dh_C)
PF01799
(Fer2_2)
PF02738
(Ald_Xan_dh_C2) 		4 PRO A 676
TYR A 180
GLY A 663
THR A 664
 None
 0.97A 3ib0A-3fahA:
undetectable		 3ib0A-3fahA:
16.54
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.
3fw0 PEPTIDYL-GLYCINE
ALPHA-AMIDATING
MONOOXYGENASE

(Rattus
norvegicus) 		PF01436
(NHL) 		4 PRO A 610
TYR A 595
GLY A 593
THR A 591
 None
 1.50A 3ib0A-3fw0A:
undetectable		 3ib0A-3fw0A:
20.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3go9 INSULINASE FAMILY
PROTEASE

(Yersinia pestis) 		PF00675
(Peptidase_M16)
PF05193
(Peptidase_M16_C) 		4 PRO A 193
TYR A 118
GLY A  66
THR A  65
 None
 1.41A 3ib0A-3go9A:
undetectable		 3ib0A-3go9A:
21.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3i1l HEMAGGLUTININ-ESTERA
SE PROTEIN

(Porcine
torovirus) 		PF02710
(Hema_HEFG)
PF03996
(Hema_esterase) 		4 PRO A 227
TYR A 242
GLY A 245
THR A 246
 None
 1.47A 3ib0A-3i1lA:
undetectable		 3ib0A-3i1lA:
19.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3jd5 28S RIBOSOMAL
PROTEIN S15,
MITOCHONDRIAL
28S RIBOSOMAL
PROTEIN S17,
MITOCHONDRIAL
28S RIBOSOMAL
PROTEIN S25,
MITOCHONDRIAL

(Bos taurus) 		PF00312
(Ribosomal_S15)
PF00366
(Ribosomal_S17)
PF14955
(MRP-S24) 		4 PRO c  72
TYR Q 105
GLY Q 102
THR O 172
 None
 1.17A 3ib0A-3jd5c:
undetectable		 3ib0A-3jd5c:
18.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ljp CHOLINE OXIDASE

(Arthrobacter
globiformis) 		PF00732
(GMC_oxred_N)
PF05199
(GMC_oxred_C) 		4 PRO A 504
TYR A 119
GLY A 120
THR A 122
 None
 1.41A 3ib0A-3ljpA:
undetectable		 3ib0A-3ljpA:
19.20
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.
3mde MEDIUM CHAIN
ACYL-COA
DEHYDROGENASE

(Sus scrofa) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N) 		4 PRO A  49
TYR A  42
GLY A  93
THR A  92
 None
 1.15A 3ib0A-3mdeA:
undetectable		 3ib0A-3mdeA:
20.43
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.
3ndn O-SUCCINYLHOMOSERINE
SULFHYDRYLASE

(Mycobacterium
tuberculosis) 		PF01053
(Cys_Met_Meta_PP) 		4 PRO A 299
TYR A 300
GLY A 318
THR A 319
 None
 1.49A 3ib0A-3ndnA:
undetectable		 3ib0A-3ndnA:
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.
3nsj PERFORIN-1

(Mus musculus) 		PF00168
(C2)
PF01823
(MACPF) 		4 PRO A  59
TYR A 218
GLY A 219
THR A 220
 None
 1.21A 3ib0A-3nsjA:
undetectable		 3ib0A-3nsjA:
19.79
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.
3oh8 NUCLEOSIDE-DIPHOSPHA
TE SUGAR EPIMERASE
(SULA FAMILY)

(Corynebacterium
glutamicum) 		PF01370
(Epimerase)
PF08338
(DUF1731) 		4 PRO A  31
TYR A 124
GLY A 120
THR A 119
 None
 1.40A 3ib0A-3oh8A:
undetectable		 3ib0A-3oh8A:
19.96
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.
3om5 LEVANSUCRASE

(Bacillus
megaterium) 		PF02435
(Glyco_hydro_68) 		4 PRO A 340
TYR A 235
GLY A 276
THR A 277
 None
 1.26A 3ib0A-3om5A:
undetectable		 3ib0A-3om5A:
21.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3prx COBRA VENOM FACTOR

(Naja kaouthia) 		PF00207
(A2M)
PF01759
(NTR)
PF01821
(ANATO)
PF01835
(A2M_N)
PF07677
(A2M_recep)
PF07678
(A2M_comp)
PF07703
(A2M_N_2)
PF10569
(Thiol-ester_cl) 		4 PRO B1453
TYR B1472
GLY B1479
THR B1478
 None
 1.43A 3ib0A-3prxB:
undetectable		 3ib0A-3prxB:
11.57
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.
3qbq TUMOR NECROSIS
FACTOR RECEPTOR
SUPERFAMILY MEMBER
11A

(Mus musculus) 		PF00020
(TNFR_c6) 		4 PRO B  71
TYR B  56
GLY B  54
THR B 108
 None
 1.37A 3ib0A-3qbqB:
undetectable		 3ib0A-3qbqB:
23.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3qz4 ENDO-1,4-BETA-XYLANA
SE D

(Bacteroides
thetaiotaomicron) 		PF04616
(Glyco_hydro_43) 		4 PRO A 206
TYR A 214
GLY A 248
THR A 249
 None
 1.38A 3ib0A-3qz4A:
undetectable		 3ib0A-3qz4A:
21.67
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.
3sfw DIHYDROPYRIMIDINASE

(Brevibacillus
agri) 		PF01979
(Amidohydro_1) 		4 PRO A 398
TYR A  49
GLY A  47
THR A  46
 ACT  A 463 ( 4.7A)
ACT  A 463 ( 3.7A)
ACT  A 463 (-3.8A)
None
 1.34A 3ib0A-3sfwA:
undetectable		 3ib0A-3sfwA:
23.96
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.
3t24 PORIN

(Pseudomonas
aeruginosa) 		PF03573
(OprD) 		4 PRO A 116
TYR A 215
GLY A 217
THR A 200
 None
None
None
C8E  A 404 (-3.9A)
 1.43A 3ib0A-3t24A:
undetectable		 3ib0A-3t24A:
22.06
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.
3vta CUCUMISIN

(Cucumis melo) 		PF00082
(Peptidase_S8) 		4 PRO A 580
TYR A 537
GLY A 533
THR A 532
 None
 1.34A 3ib0A-3vtaA:
undetectable		 3ib0A-3vtaA:
19.01
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.
3wso F-BOX ONLY PROTEIN
44

(Homo sapiens) 		PF04300
(FBA)
PF12937
(F-box-like) 		4 PRO A 217
TYR A 216
GLY A 189
THR A 190
 None
 1.45A 3ib0A-3wsoA:
undetectable		 3ib0A-3wsoA:
21.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3zu0 NAD NUCLEOTIDASE

(Haemophilus
influenzae) 		PF00149
(Metallophos)
PF02872
(5_nucleotid_C) 		4 PRO A 491
TYR A 498
GLY A 493
THR A 429
 None
 1.41A 3ib0A-3zu0A:
undetectable		 3ib0A-3zu0A:
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.
4a7k ALDOS-2-ULOSE
DEHYDRATASE

(Phanerochaete
chrysosporium) 		no annotation 4 PRO A  94
TYR A  55
GLY A  58
THR A  59
 None
 1.41A 3ib0A-4a7kA:
undetectable		 3ib0A-4a7kA:
17.57
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.
4c3o HYDROGENASE-1 LARGE
SUBUNIT

(Salmonella
enterica) 		PF00374
(NiFeSe_Hases) 		4 PRO A 541
TYR A 398
GLY A  50
THR A  51
 None
 1.14A 3ib0A-4c3oA:
undetectable		 3ib0A-4c3oA:
20.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4f88 PLYCA

(Streptococcus
virus C1) 		PF05257
(CHAP) 		4 PRO 1 117
TYR 1 115
GLY 1 215
THR 1 216
 None
 1.18A 3ib0A-4f881:
undetectable		 3ib0A-4f881:
21.46
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4fim LACTOTRANSFERRIN

(Bos taurus) 		PF00405
(Transferrin) 		4 PRO A 593
TYR A 660
GLY A 662
THR A 663
 CEL  A 711 (-4.3A)
CEL  A 711 (-4.4A)
CEL  A 711 (-3.3A)
None
 0.11A 3ib0A-4fimA:
60.1		 3ib0A-4fimA:
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.
4ifd EXOSOME COMPLEX
COMPONENT RRP43

(Saccharomyces
cerevisiae) 		PF01138
(RNase_PH) 		4 PRO C 244
TYR C 211
GLY C  93
THR C  92
 None
 1.37A 3ib0A-4ifdC:
undetectable		 3ib0A-4ifdC:
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.
4kiw 3-DEHYDROQUINATE
DEHYDRATASE

(Mycobacterium
tuberculosis) 		PF01220
(DHquinase_II) 		4 PRO A  21
TYR A  24
GLY A  17
THR A  28
 None
KIW  A 500 (-4.2A)
None
None
 1.49A 3ib0A-4kiwA:
undetectable		 3ib0A-4kiwA:
19.58
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.
4kqn D-HYDANTOINASE

(Bacillus sp.
AR9) 		PF01979
(Amidohydro_1) 		4 PRO A 398
TYR A  49
GLY A  47
THR A  46
 PRO  A 398 ( 1.1A)
TYR  A  49 ( 1.3A)
GLY  A  47 ( 0.0A)
THR  A  46 ( 0.8A)
 1.41A 3ib0A-4kqnA:
undetectable		 3ib0A-4kqnA:
20.25
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.
4mju NEURAMINIDASE

(Influenza A
virus) 		PF00064
(Neur) 		4 PRO A 326
TYR A 347
GLY A 346
THR A 296
 None
 1.44A 3ib0A-4mjuA:
undetectable		 3ib0A-4mjuA:
20.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4mmo SSO-CP2
METALLO-CARBOXYPETID
ASE

(Sulfolobus
solfataricus) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		4 PRO A 207
TYR A 191
GLY A 192
THR A 193
 None
 1.22A 3ib0A-4mmoA:
undetectable		 3ib0A-4mmoA:
22.32
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.
4n2r ALPHA-L-ARABINOFURAN
OSIDASE UMABF62A

(Ustilago maydis) 		PF03664
(Glyco_hydro_62) 		4 PRO A 141
TYR A 165
GLY A 132
THR A 180
 None
None
None
TRS  A 404 (-3.1A)
 1.45A 3ib0A-4n2rA:
undetectable		 3ib0A-4n2rA:
21.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4n3s EUKARYOTIC
TRANSLATION
INITIATION FACTOR 5B

(Saccharomyces
cerevisiae) 		PF00009
(GTP_EFTU)
PF03144
(GTP_EFTU_D2)
PF11987
(IF-2) 		4 PRO A 778
TYR A 805
GLY A 752
THR A 751
 None
 1.47A 3ib0A-4n3sA:
undetectable		 3ib0A-4n3sA:
21.14
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.
4p13 MEDIUM-CHAIN
SPECIFIC ACYL-COA
DEHYDROGENASE,
MITOCHONDRIAL

(Homo sapiens) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N) 		4 PRO A  49
TYR A  42
GLY A  93
THR A  92
 None
 1.16A 3ib0A-4p13A:
undetectable		 3ib0A-4p13A:
21.07
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.
4pfw ABC TRANSPORTER
SUBSTRATE-BINDING
PROTEIN

(Thermotoga
maritima) 		PF00496
(SBP_bac_5) 		4 PRO A 189
TYR A 190
GLY A  55
THR A  54
 None
 1.48A 3ib0A-4pfwA:
4.4		 3ib0A-4pfwA:
21.88
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.
4ptf DNA POLYMERASE
EPSILON CATALYTIC
SUBUNIT A

(Saccharomyces
cerevisiae) 		PF00136
(DNA_pol_B)
PF03104
(DNA_pol_B_exo1) 		4 PRO A 137
TYR A 135
GLY A 116
THR A  85
 None
 1.28A 3ib0A-4ptfA:
undetectable		 3ib0A-4ptfA:
14.64
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.
4uzu ALPHA-AMYLASE

(Geobacillus
stearothermophilus) 		PF00128
(Alpha-amylase)
PF09154
(DUF1939) 		4 PRO A  45
TYR A  57
GLY A  58
THR A  50
 None
 1.47A 3ib0A-4uzuA:
undetectable		 3ib0A-4uzuA:
21.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4wfw GENERAL SECRETION
PATHWAY PROTEIN B

(Dickeya
dadantii) 		PF16537
(T2SSB) 		4 PRO A 128
TYR A 160
GLY A 118
THR A 117
 None
 1.50A 3ib0A-4wfwA:
undetectable		 3ib0A-4wfwA:
13.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4xk1 PHOSPHOSERINE
AMINOTRANSFERASE

(Pseudomonas
aeruginosa) 		PF00266
(Aminotran_5) 		4 PRO A  85
TYR A 114
GLY A 115
THR A 116
 None
 1.10A 3ib0A-4xk1A:
undetectable		 3ib0A-4xk1A:
22.72
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.
4xkq NICKEL ABC
TRANSPORTER
SUBSTRATE-BINDING
PROTEIN

(Staphylococcus
aureus) 		PF00496
(SBP_bac_5) 		4 PRO A 180
TYR A 156
GLY A 154
THR A 153
 None
 0.89A 3ib0A-4xkqA:
2.2		 3ib0A-4xkqA:
20.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4xwh ALPHA-N-ACETYLGLUCOS
AMINIDASE

(Homo sapiens) 		PF05089
(NAGLU)
PF12971
(NAGLU_N)
PF12972
(NAGLU_C) 		4 PRO A 215
TYR A 638
GLY A 195
THR A 194
 None
 1.40A 3ib0A-4xwhA:
undetectable		 3ib0A-4xwhA:
17.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4yv2 SPERMIDINE SYNTHASE,
PUTATIVE

(Trypanosoma
cruzi) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		4 PRO A  52
TYR A  68
GLY A  54
THR A  55
 None
 1.45A 3ib0A-4yv2A:
1.7		 3ib0A-4yv2A:
21.77
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.
4ze8 ABC TRANSPORTER,
SUBSTRATE BINDING
PROTEIN
(AGROCINOPINES A AND
B)

(Agrobacterium
fabrum) 		PF00496
(SBP_bac_5) 		4 PRO A 230
TYR A 206
GLY A 204
THR A 203
 None
 0.90A 3ib0A-4ze8A:
2.5		 3ib0A-4ze8A:
20.86
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.
5ed7 TEGUMENT PROTEIN
UL21

(Human
alphaherpesvirus
1) 		PF03252
(Herpes_UL21) 		4 PRO A 418
TYR A 458
GLY A 484
THR A 486
 None
 1.43A 3ib0A-5ed7A:
undetectable		 3ib0A-5ed7A:
20.11
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.
5eod COAGULATION FACTOR
XI

(Homo sapiens) 		PF00024
(PAN_1)
PF00089
(Trypsin) 		4 PRO A 316
TYR A 314
GLY A 347
THR A 281
 None
 1.11A 3ib0A-5eodA:
undetectable		 3ib0A-5eodA:
18.06
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.
5l8s AMINO ACYL PEPTIDASE

(Sporosarcina
psychrophila) 		PF00326
(Peptidase_S9) 		4 PRO A 430
TYR A 459
GLY A 410
THR A 419
 None
 1.04A 3ib0A-5l8sA:
undetectable		 3ib0A-5l8sA:
19.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5lz6 GOLGI RESIDENT
PROTEIN GCP60

(Homo sapiens) 		PF13897
(GOLD_2) 		4 PRO A 499
TYR A 504
GLY A 502
THR A 436
 None
 1.08A 3ib0A-5lz6A:
undetectable		 3ib0A-5lz6A:
18.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5mq6 PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE-LIKE
PROTEIN

(Thermothelomyces
thermophila) 		PF07992
(Pyr_redox_2) 		4 PRO A 421
TYR A  26
GLY A 595
THR A 594
 None
 1.28A 3ib0A-5mq6A:
undetectable		 3ib0A-5mq6A:
18.71
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.
5n8o DNA HELICASE I

(Escherichia
coli) 		PF07057
(TraI)
PF08751
(TrwC)
PF13604
(AAA_30) 		4 PRO A1472
TYR A 926
GLY A 927
THR A 928
 None
 1.17A 3ib0A-5n8oA:
undetectable		 3ib0A-5n8oA:
11.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5oki DNA POLYMERASE
EPSILON CATALYTIC
SUBUNIT A

(Saccharomyces
cerevisiae) 		no annotation 4 PRO A 137
TYR A 135
GLY A 116
THR A  85
 None
 1.22A 3ib0A-5okiA:
undetectable		 3ib0A-5okiA:
11.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5t81 EPOB

(Sorangium
cellulosum) 		PF00668
(Condensation) 		4 PRO A 444
TYR A  81
GLY A  84
THR A  86
 None
 1.01A 3ib0A-5t81A:
undetectable		 3ib0A-5t81A:
20.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5wu7 UNCHARACTERIZED
PROTEIN

(Pyrococcus
horikoshii) 		PF03065
(Glyco_hydro_57)
PF09210
(DUF1957) 		4 PRO A 404
TYR A 188
GLY A 406
THR A 413
 None
 1.41A 3ib0A-5wu7A:
undetectable		 3ib0A-5wu7A:
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.
6bhv POLY [ADP-RIBOSE]
POLYMERASE 1

(Homo sapiens) 		no annotation 4 PRO A 970
TYR A 817
GLY A 972
THR A 973
 None
 1.25A 3ib0A-6bhvA:
undetectable		 3ib0A-6bhvA:
13.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6cmj CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE KINASE 2

(Homo sapiens) 		no annotation 4 PRO A 410
TYR A 381
GLY A 386
THR A 280
 None
 1.22A 3ib0A-6cmjA:
undetectable		 3ib0A-6cmjA:
11.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6esb CAPSID PROTEIN VP1

(Human
polyomavirus 1) 		no annotation 4 PRO 1 210
TYR 1 220
GLY 1 222
THR 1 223
 None
 1.36A 3ib0A-6esb1:
undetectable		 3ib0A-6esb1:
12.42
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.
6fhv GLUCOAMYLASE

(Penicillium
oxalicum) 		no annotation 4 PRO A 343
TYR A 342
GLY A 279
THR A 268
 None
 1.37A 3ib0A-6fhvA:
undetectable		 3ib0A-6fhvA:
14.03
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.
6geb DOTB

(Legionella
pneumophila) 		no annotation 4 PRO A 147
TYR A 256
GLY A 150
THR A 290
 None
 0.97A 3ib0A-6gebA:
undetectable		 3ib0A-6gebA:
13.83