SIMILAR PATTERNS OF AMINO ACIDS FOR 5IKT_A_TLFA601_1

List of similar pattern of amino acids derived from ASSAM search

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

(Click link on the last column to view superposed patterns of amino acids in NGL viewer)
(Note that only 3-12 residue patterns can be used for ASSAM searches)
Filter list by:
Hit Macromolecule/
Organism		 Pfam Res. Interface HETATM RMSD Dali Z-score Seq. Identity (%) View Dock
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1cs1 PROTEIN
(CYSTATHIONINE
GAMMA-SYNTHASE)

(Escherichia
coli) 		PF01053
(Cys_Met_Meta_PP) 		3 LEU A 327
TYR A 101
SER A 195
 LLP  A 198 ( 4.6A)
LLP  A 198 ( 3.6A)
LLP  A 198 ( 2.8A)
 0.74A 5iktA-1cs1A:
0.0		 5iktA-1cs1A:
20.84
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.
1dot DUCK OVOTRANSFERRIN

(Anas
platyrhynchos) 		PF00405
(Transferrin) 		3 LEU A  69
TYR A 325
SER A 316
 None
 0.79A 5iktA-1dotA:
0.0		 5iktA-1dotA:
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.
1ej6 LAMBDA1

(Reovirus sp.) 		no annotation 3 LEU B1209
TYR B1150
SER B1057
 None
 0.73A 5iktA-1ej6B:
0.0		 5iktA-1ej6B:
18.22
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.
1ej6 LAMBDA1

(Reovirus sp.) 		no annotation 3 LEU B1209
TYR B1150
SER B1185
 None
 0.68A 5iktA-1ej6B:
0.0		 5iktA-1ej6B:
18.22
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.
1kol FORMALDEHYDE
DEHYDROGENASE

(Pseudomonas
putida) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		3 LEU A 236
TYR A 190
SER A 285
 NAD  A1403 ( 4.4A)
None
None
 0.72A 5iktA-1kolA:
0.0		 5iktA-1kolA:
21.63
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.
1ly7 FRATAXIN

(Homo sapiens) 		PF01491
(Frataxin_Cyay) 		3 LEU A 185
TYR A 143
SER A 160
 None
 0.86A 5iktA-1ly7A:
0.0		 5iktA-1ly7A:
11.92
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.
1n8p CYSTATHIONINE
GAMMA-LYASE

(Saccharomyces
cerevisiae) 		PF01053
(Cys_Met_Meta_PP) 		3 LEU A 335
TYR A 103
SER A 200
 None
PLP  A 400 (-3.6A)
PLP  A 400 (-2.7A)
 0.71A 5iktA-1n8pA:
undetectable		 5iktA-1n8pA:
21.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ofe FERREDOXIN-DEPENDENT
GLUTAMATE SYNTHASE 2

(Synechocystis
sp. PCC 6803) 		PF00310
(GATase_2)
PF01493
(GXGXG)
PF01645
(Glu_synthase)
PF04898
(Glu_syn_central) 		3 LEU A 834
TYR A 794
SER A 798
 None
 0.84A 5iktA-1ofeA:
0.0		 5iktA-1ofeA:
17.18
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.
1orf GRANZYME A

(Homo sapiens) 		PF00089
(Trypsin) 		3 LEU A 155
TYR A  29
SER A 197
 None
 0.90A 5iktA-1orfA:
0.0		 5iktA-1orfA:
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.
1pgu ACTIN INTERACTING
PROTEIN 1

(Saccharomyces
cerevisiae) 		PF00400
(WD40) 		3 LEU A 292
TYR A 324
SER A 314
 None
 0.87A 5iktA-1pguA:
0.0		 5iktA-1pguA:
21.86
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.
1pox PYRUVATE OXIDASE

(Lactobacillus
plantarum) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		3 LEU A 274
TYR A 287
SER A 293
 None
FAD  A 612 (-4.7A)
None
 0.83A 5iktA-1poxA:
undetectable		 5iktA-1poxA:
20.12
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.
1qwk ALDO-KETO REDUCTASE
FAMILY 1 MEMBER C1

(Caenorhabditis
elegans) 		PF00248
(Aldo_ket_red) 		3 LEU A  87
TYR A 111
SER A  50
 None
 0.83A 5iktA-1qwkA:
undetectable		 5iktA-1qwkA:
20.31
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.
1uli BIPHENYL DIOXYGENASE
LARGE SUBUNIT

(Rhodococcus
jostii) 		PF00355
(Rieske)
PF00848
(Ring_hydroxyl_A) 		3 LEU A 309
TYR A 415
SER A 302
 None
 0.85A 5iktA-1uliA:
undetectable		 5iktA-1uliA:
21.68
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.
1w8o BACTERIAL SIALIDASE

(Micromonospora
viridifaciens) 		PF00754
(F5_F8_type_C)
PF10633
(NPCBM_assoc)
PF13088
(BNR_2) 		3 LEU A 376
TYR A 393
SER A 104
 None
 0.90A 5iktA-1w8oA:
undetectable		 5iktA-1w8oA:
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.
2apo PROBABLE TRNA
PSEUDOURIDINE
SYNTHASE B

(Methanocaldococcus
jannaschii) 		PF01472
(PUA)
PF01509
(TruB_N)
PF08068
(DKCLD)
PF16198
(TruB_C_2) 		3 LEU A  80
TYR A 109
SER A 204
 None
None
K  A 503 (-2.8A)
 0.63A 5iktA-2apoA:
undetectable		 5iktA-2apoA:
20.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2d3i OVOTRANSFERRIN

(Gallus gallus) 		PF00405
(Transferrin) 		3 LEU A  69
TYR A 325
SER A 316
 None
 0.86A 5iktA-2d3iA:
undetectable		 5iktA-2d3iA:
21.22
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.
2dph FORMALDEHYDE
DISMUTASE

(Pseudomonas
putida) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		3 LEU A 236
TYR A 190
SER A 284
 NAD  A1403 (-4.7A)
None
None
 0.88A 5iktA-2dphA:
undetectable		 5iktA-2dphA:
20.31
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.
2fa0 HMG-COA SYNTHASE

(Brassica juncea) 		PF01154
(HMG_CoA_synt_N)
PF08540
(HMG_CoA_synt_C) 		3 LEU A 125
TYR A 118
SER A 184
 None
 0.61A 5iktA-2fa0A:
undetectable		 5iktA-2fa0A:
22.04
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.
2gsk VITAMIN B12
TRANSPORTER BTUB

(Escherichia
coli) 		PF00593
(TonB_dep_Rec)
PF07715
(Plug) 		3 LEU A  85
TYR A 223
SER A 249
 None
 0.89A 5iktA-2gskA:
undetectable		 5iktA-2gskA:
21.71
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.
2gzs IROE PROTEIN

(Escherichia
coli) 		PF00756
(Esterase) 		3 LEU A 145
TYR A 190
SER A 154
 None
DFP  A1189 (-3.5A)
None
 0.86A 5iktA-2gzsA:
undetectable		 5iktA-2gzsA:
18.57
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.
2j7n RNA-DEPENDENT RNA
POLYMERASE

(Neurospora
crassa) 		PF05183
(RdRP) 		3 LEU A 798
TYR A 919
SER A 917
 None
 0.87A 5iktA-2j7nA:
undetectable		 5iktA-2j7nA:
19.90
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.
2l29 INSULIN-LIKE GROWTH
FACTOR 2 RECEPTOR
VARIANT

(Homo sapiens) 		PF00878
(CIMR) 		3 LEU A1629
TYR A1606
SER A1600
 None
 0.89A 5iktA-2l29A:
undetectable		 5iktA-2l29A:
12.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2lla MANNOSE-6-PHOSPHATE/
INSULIN-LIKE GROWTH
FACTOR II RECEPTOR

(Tachyglossus
aculeatus) 		PF00878
(CIMR) 		3 LEU A1507
TYR A1516
SER A1600
 None
 0.80A 5iktA-2llaA:
undetectable		 5iktA-2llaA:
13.62
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.
2r8q CLASS I
PHOSPHODIESTERASE
PDEB1

(Leishmania
major) 		PF00233
(PDEase_I) 		3 LEU A 715
TYR A 698
SER A 651
 None
 0.74A 5iktA-2r8qA:
undetectable		 5iktA-2r8qA:
19.41
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.
2ri0 GLUCOSAMINE-6-PHOSPH
ATE DEAMINASE

(Streptococcus
mutans) 		PF01182
(Glucosamine_iso) 		3 LEU A 149
TYR A  75
SER A 173
 None
 0.85A 5iktA-2ri0A:
undetectable		 5iktA-2ri0A:
17.68
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.
2x3c TOXIC EXTRACELLULAR
ENDOPEPTIDASE

(Aeromonas
salmonicida) 		PF14521
(Aspzincin_M35) 		3 LEU A 326
TYR A 217
SER A 225
 None
 0.82A 5iktA-2x3cA:
undetectable		 5iktA-2x3cA:
18.72
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.
2yij PHOSPHOLIPASE
A1-IIGAMMA

(Arabidopsis
thaliana) 		PF01764
(Lipase_3) 		3 LEU A 144
TYR A  50
SER A  27
 None
 0.84A 5iktA-2yijA:
undetectable		 5iktA-2yijA:
20.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ykf PROBABLE SENSOR
HISTIDINE KINASE
PDTAS

(Mycobacterium
tuberculosis) 		PF12282
(H_kinase_N) 		3 LEU A 277
TYR A 146
SER A 194
 None
SO4  A1287 (-4.8A)
BR  A1289 ( 4.0A)
 0.88A 5iktA-2ykfA:
undetectable		 5iktA-2ykfA:
19.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2yyo SPRY
DOMAIN-CONTAINING
PROTEIN 3

(Homo sapiens) 		PF00622
(SPRY) 		3 LEU A 161
TYR A  30
SER A  33
 None
 0.82A 5iktA-2yyoA:
undetectable		 5iktA-2yyoA:
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.
2z66 VARIABLE LYMPHOCYTE
RECEPTOR B,
TOLL-LIKE RECEPTOR 4

(Eptatretus
burgeri;
Homo sapiens) 		PF01462
(LRRNT)
PF13855
(LRR_8) 		3 LEU A 511
TYR A 551
SER A 534
 None
 0.83A 5iktA-2z66A:
undetectable		 5iktA-2z66A:
20.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3b8b CYSQ, SULFITE
SYNTHESIS PATHWAY
PROTEIN

(Bacteroides
thetaiotaomicron) 		PF00459
(Inositol_P) 		3 LEU A 158
TYR A 122
SER A 134
 None
None
CSO  A 133 ( 3.7A)
 0.75A 5iktA-3b8bA:
undetectable		 5iktA-3b8bA:
19.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3d3s L-2,4-DIAMINOBUTYRIC
ACID
ACETYLTRANSFERASE

(Bordetella
parapertussis) 		PF00583
(Acetyltransf_1) 		3 LEU A  25
TYR A  33
SER A  59
 None
 0.90A 5iktA-3d3sA:
undetectable		 5iktA-3d3sA:
16.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3eqq BENZENE
1,2-DIOXYGENASE
SUBUNIT ALPHA

(Pseudomonas
putida) 		PF00355
(Rieske)
PF00848
(Ring_hydroxyl_A) 		3 LEU A 307
TYR A 413
SER A 300
 None
 0.90A 5iktA-3eqqA:
undetectable		 5iktA-3eqqA:
21.49
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.
3ezs AMINOTRANSFERASE
ASPB

(Helicobacter
pylori) 		PF00155
(Aminotran_1_2) 		3 LEU A 259
TYR A 252
SER A  99
 None
 0.84A 5iktA-3ezsA:
undetectable		 5iktA-3ezsA:
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.
3ga4 DOLICHYL-DIPHOSPHOOL
IGOSACCHARIDE-PROTEI
N
GLYCOSYLTRANSFERASE
SUBUNIT OST6

(Saccharomyces
cerevisiae) 		PF04756
(OST3_OST6) 		3 LEU A  98
TYR A 109
SER A  31
 PG4  A 178 (-4.0A)
None
None
 0.69A 5iktA-3ga4A:
undetectable		 5iktA-3ga4A:
16.22
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.
3h1v GLUCOKINASE

(Homo sapiens) 		PF00349
(Hexokinase_1)
PF03727
(Hexokinase_2) 		3 LEU X  45
TYR X 234
SER X 396
 None
 0.89A 5iktA-3h1vX:
undetectable		 5iktA-3h1vX:
21.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3hjw PSEUDOURIDINE
SYNTHASE CBF5

(Pyrococcus
furiosus) 		PF01472
(PUA)
PF01509
(TruB_N)
PF08068
(DKCLD)
PF16198
(TruB_C_2) 		3 LEU A  84
TYR A 113
SER A 208
 None
 0.82A 5iktA-3hjwA:
undetectable		 5iktA-3hjwA:
19.56
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.
3ki6 CHOLIX TOXIN

(Vibrio cholerae) 		PF09009
(Exotox-A_cataly) 		3 LEU A 442
TYR A 532
SER A 621
 None
 0.89A 5iktA-3ki6A:
undetectable		 5iktA-3ki6A:
17.33
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.
3l9r CD1B3

(Bos taurus) 		PF07654
(C1-set)
PF16497
(MHC_I_3) 		3 LEU A  32
TYR A 169
SER A  54
 None
 0.88A 5iktA-3l9rA:
undetectable		 5iktA-3l9rA:
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.
3mq3 PYRUVATE
DEHYDROGENASE
PHOSPHATASE 1

(Bos taurus) 		PF00481
(PP2C) 		3 LEU A 189
TYR A 137
SER A 130
 None
 0.88A 5iktA-3mq3A:
undetectable		 5iktA-3mq3A:
21.64
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.
3ozq SERPIN48

(Tenebrio
molitor) 		PF00079
(Serpin) 		3 LEU A 256
TYR A  36
SER A 266
 None
 0.86A 5iktA-3ozqA:
undetectable		 5iktA-3ozqA:
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.
3qhq SAG0897 FAMILY
CRISPR-ASSOCIATED
PROTEIN

(Streptococcus
agalactiae) 		PF09711
(Cas_Csn2) 		3 LEU A 159
TYR A  69
SER A  73
 None
 0.86A 5iktA-3qhqA:
undetectable		 5iktA-3qhqA:
19.10
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.
3qi6 CYSTATHIONINE
GAMMA-SYNTHASE METB
(CGS)

(Mycobacterium
ulcerans) 		PF01053
(Cys_Met_Meta_PP) 		3 LEU A 337
TYR A 111
SER A 205
 LLP  A 208 (-4.2A)
LLP  A 208 (-3.7A)
LLP  A 208 ( 2.7A)
 0.88A 5iktA-3qi6A:
undetectable		 5iktA-3qi6A:
20.51
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.
3rc3 ATP-DEPENDENT RNA
HELICASE SUPV3L1,
MITOCHONDRIAL

(Homo sapiens) 		PF00271
(Helicase_C)
PF12513
(SUV3_C) 		3 LEU A 361
TYR A 441
SER A 380
 None
 0.84A 5iktA-3rc3A:
undetectable		 5iktA-3rc3A:
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.
3s5u PUTATIVE
UNCHARACTERIZED
PROTEIN

(Enterococcus
faecalis) 		PF09711
(Cas_Csn2) 		3 LEU A 158
TYR A  68
SER A  72
 None
 0.80A 5iktA-3s5uA:
undetectable		 5iktA-3s5uA:
17.04
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.
3sze SERINE PROTEASE ESPP

(Escherichia
coli) 		PF02395
(Peptidase_S6) 		3 LEU A 875
TYR A 908
SER A 880
 None
 0.78A 5iktA-3szeA:
undetectable		 5iktA-3szeA:
19.57
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.
3v5n OXIDOREDUCTASE

(Sinorhizobium
meliloti) 		PF01408
(GFO_IDH_MocA)
PF02894
(GFO_IDH_MocA_C) 		3 LEU A  84
TYR A  71
SER A  68
 None
 0.74A 5iktA-3v5nA:
undetectable		 5iktA-3v5nA:
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.
3vrb FLAVOPROTEIN SUBUNIT
OF COMPLEX II

(Ascaris suum) 		PF00890
(FAD_binding_2)
PF02910
(Succ_DH_flav_C) 		3 LEU A 433
TYR A 645
SER A 157
 None
 0.89A 5iktA-3vrbA:
undetectable		 5iktA-3vrbA:
20.32
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.
3vxi DYP

(Bjerkandera
adusta) 		PF04261
(Dyp_perox) 		3 LEU A 122
TYR A 359
SER A 330
 None
 0.87A 5iktA-3vxiA:
undetectable		 5iktA-3vxiA:
22.45
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.
4azv WBDD

(Escherichia
coli) 		PF00069
(Pkinase)
PF13847
(Methyltransf_31) 		3 LEU A 198
TYR A  16
SER A 129
 None
SAM  A1474 (-3.5A)
SAM  A1474 ( 4.5A)
 0.68A 5iktA-4azvA:
undetectable		 5iktA-4azvA:
22.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4co6 NUCLEOPROTEIN
PHOSPHOPROTEIN

(Nipah
henipavirus;
Nipah
henipavirus) 		PF00973
(Paramyxo_ncap)
PF14313
(Soyouz_module) 		3 LEU A 362
TYR D  28
SER D  37
 None
CL  A1374 (-4.7A)
None
 0.72A 5iktA-4co6A:
0.5		 5iktA-4co6A:
20.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4dn7 ABC TRANSPORTER,
ATP-BINDING PROTEIN

(Methanosarcina
mazei) 		PF01458
(UPF0051) 		3 LEU A 148
TYR A 130
SER A 192
 None
 0.80A 5iktA-4dn7A:
undetectable		 5iktA-4dn7A:
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.
4ewg BETA-KETOACYL
SYNTHASE

(Paraburkholderia
phymatum) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		3 LEU A 329
TYR A 297
SER A 390
 None
 0.83A 5iktA-4ewgA:
undetectable		 5iktA-4ewgA:
20.78
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.
4g0b HYDROXYCINNAMOYL-COA
SHIKIMATE/QUINATE
HYDROXYCINNAMOYLTRAN
SFERASE

(Coffea
canephora) 		PF02458
(Transferase) 		3 LEU A 162
TYR A  40
SER A  38
 None
 0.69A 5iktA-4g0bA:
undetectable		 5iktA-4g0bA:
21.12
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.
4i1d ABC TRANSPORTER
SUBSTRATE-BINDING
PROTEIN

(Bradyrhizobium
diazoefficiens) 		PF13416
(SBP_bac_8) 		3 LEU A  63
TYR A 142
SER A  49
 None
 0.89A 5iktA-4i1dA:
undetectable		 5iktA-4i1dA:
19.10
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.
4i66 UNCHARACTERIZED
PROTEIN HOCH_4089

(Haliangium
ochraceum) 		PF13709
(DUF4159) 		3 LEU A 124
TYR A 189
SER A 119
 None
 0.89A 5iktA-4i66A:
undetectable		 5iktA-4i66A:
16.89
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.
4i6m ACTIN-RELATED
PROTEIN 7
ACTIN-LIKE PROTEIN
ARP9
REGULATOR OF TY1
TRANSPOSITION
PROTEIN 102

(Saccharomyces
cerevisiae;
Saccharomyces
cerevisiae;
Saccharomyces
cerevisiae) 		PF00022
(Actin)
PF00022
(Actin)
PF09510
(Rtt102p) 		3 LEU A 102
TYR D  27
SER B 122
 None
 0.60A 5iktA-4i6mA:
undetectable		 5iktA-4i6mA:
23.30
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.
4j9t DESIGNED UNNATURAL
AMINO ACID DEPENDENT
METALLOPROTEIN

(Micromonospora
viridifaciens) 		PF13088
(BNR_2) 		3 LEU A 376
TYR A 393
SER A 104
 None
 0.87A 5iktA-4j9tA:
undetectable		 5iktA-4j9tA:
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.
4jlw GLUTATHIONE-INDEPEND
ENT FORMALDEHYDE
DEHYDROGENASE

(Pseudomonas
aeruginosa) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		3 LEU A 237
TYR A 191
SER A 286
 NAD  A 403 ( 4.9A)
None
SO4  A 404 (-3.8A)
 0.68A 5iktA-4jlwA:
undetectable		 5iktA-4jlwA:
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.
4jq6 PROTEORHODOPSIN

(uncultured
bacterium) 		PF01036
(Bac_rhodopsin) 		3 LEU A 210
TYR A  58
SER A  14
 None
 0.79A 5iktA-4jq6A:
undetectable		 5iktA-4jq6A:
18.44
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.
4jy4 PGT121 HEAVY CHAIN

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set) 		3 LEU B  63
TYR B  90
SER B  40
 None
 0.85A 5iktA-4jy4B:
undetectable		 5iktA-4jy4B:
17.78
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.
4k2b NTD BIOSYNTHESIS
OPERON PROTEIN NTDA

(Bacillus
subtilis) 		PF01041
(DegT_DnrJ_EryC1) 		3 LEU A 159
TYR A 395
SER A 383
 None
 0.89A 5iktA-4k2bA:
undetectable		 5iktA-4k2bA:
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.
4ke4 HYDROXYCINNAMOYL-COA
:SHIKIMATE
HYDROXYCINNAMOYL
TRANSFERASE

(Sorghum bicolor) 		PF02458
(Transferase) 		3 LEU A 171
TYR A  40
SER A  38
 None
 0.79A 5iktA-4ke4A:
undetectable		 5iktA-4ke4A:
20.92
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.
4kw3 NS1

(Human bocavirus) 		no annotation 3 LEU A 125
TYR A  18
SER A 133
 None
 0.89A 5iktA-4kw3A:
undetectable		 5iktA-4kw3A:
18.79
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.
4lcm TRANSESTERASE

(Aspergillus
terreus) 		PF00144
(Beta-lactamase) 		3 LEU A 149
TYR A 327
SER A 322
 None
 0.84A 5iktA-4lcmA:
undetectable		 5iktA-4lcmA:
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.
4n7c BLA G 4 ALLERGEN
VARIANT 1

(Blattella
germanica) 		PF03973
(Triabin) 		3 LEU A 147
TYR A 168
SER A 173
 None
 0.76A 5iktA-4n7cA:
undetectable		 5iktA-4n7cA:
15.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4q2c CRISPR-ASSOCIATED
HELICASE CAS3

(Thermobaculum
terrenum) 		PF00271
(Helicase_C) 		3 LEU A 357
TYR A 354
SER A 392
 None
 0.89A 5iktA-4q2cA:
undetectable		 5iktA-4q2cA:
19.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4r4z PNGF-II

(Elizabethkingia
meningoseptica) 		PF09112
(N-glycanase_N)
PF09113
(N-glycanase_C) 		3 LEU A 134
TYR A   8
SER A  25
 None
 0.83A 5iktA-4r4zA:
undetectable		 5iktA-4r4zA:
21.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4u14 MUSCARINIC
ACETYLCHOLINE
RECEPTOR
M3,ENDOLYSIN,MUSCARI
NIC ACETYLCHOLINE
RECEPTOR M3

(Rattus
norvegicus;
Escherichia
virus T4) 		PF00001
(7tm_1)
PF00959
(Phage_lysozyme) 		3 LEU A 144
TYR A 529
SER A 120
 None
0HK  A2000 (-4.1A)
None
 0.76A 5iktA-4u14A:
0.2		 5iktA-4u14A:
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.
4x6k ANHYDROSIALIDASE

([Ruminococcus]
gnavus) 		PF13088
(BNR_2) 		3 LEU A 683
TYR A 711
SER A 294
 None
 0.84A 5iktA-4x6kA:
undetectable		 5iktA-4x6kA:
19.45
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.
4xhb SIALIDASE B

(Streptococcus
pneumoniae) 		PF02012
(BNR)
PF02973
(Sialidase)
PF13088
(BNR_2) 		3 LEU A 659
TYR A 687
SER A 282
 None
 0.88A 5iktA-4xhbA:
undetectable		 5iktA-4xhbA:
20.90
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.
4yw5 NEURAMINIDASE C

(Streptococcus
pneumoniae) 		PF02012
(BNR)
PF02973
(Sialidase)
PF13088
(BNR_2) 		3 LEU A 701
TYR A 729
SER A 327
 None
 0.89A 5iktA-4yw5A:
undetectable		 5iktA-4yw5A:
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.
4zrq TRANSCOBALAMIN-2

(Homo sapiens) 		PF01122
(Cobalamin_bind)
PF14478
(DUF4430) 		3 LEU A 358
TYR A  62
SER A  83
 CNC  A 501 (-3.6A)
None
CNC  A 501 ( 4.3A)
 0.89A 5iktA-4zrqA:
0.7		 5iktA-4zrqA:
21.91
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.
5boe ENOLASE

(Staphylococcus
aureus) 		PF00113
(Enolase_C)
PF03952
(Enolase_N) 		3 LEU A 278
TYR A 258
SER A 247
 None
 0.78A 5iktA-5boeA:
undetectable		 5iktA-5boeA:
23.09
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.
5cg0 BETA-GLUCOSIDASE

(Spodoptera
frugiperda) 		PF00232
(Glyco_hydro_1) 		3 LEU A 446
TYR A 125
SER A  77
 None
 0.89A 5iktA-5cg0A:
undetectable		 5iktA-5cg0A:
19.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5cwu NUCLEOPORIN NUP188

(Chaetomium
thermophilum) 		no annotation 3 LEU A1685
TYR A1677
SER A1717
 None
 0.77A 5iktA-5cwuA:
1.2		 5iktA-5cwuA:
22.55
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.
5dqf SERUM ALBUMIN

(Equus caballus) 		PF00273
(Serum_albumin) 		3 LEU A 452
TYR A 410
SER A 488
 None
 0.81A 5iktA-5dqfA:
undetectable		 5iktA-5dqfA:
21.84
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.
5e4i CONTACTIN-5

(Mus musculus) 		PF07679
(I-set)
PF13927
(Ig_3) 		3 LEU A 358
TYR A 366
SER A 344
 None
 0.87A 5iktA-5e4iA:
undetectable		 5iktA-5e4iA:
20.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5exv HEMIN-DEGRADING
HEMS.CHUX DOMAIN
PROTEIN

(Vibrio cholerae) 		PF06228
(ChuX_HutX) 		3 LEU A  19
TYR A 141
SER A 124
 None
 0.77A 5iktA-5exvA:
undetectable		 5iktA-5exvA:
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.
5ghk SERUM ALBUMIN

(Canis lupus) 		PF00273
(Serum_albumin) 		3 LEU A 457
TYR A 411
SER A 489
 None
 0.89A 5iktA-5ghkA:
undetectable		 5iktA-5ghkA:
21.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5h2r PHOSPHODIESTERASE

(Trypanosoma
brucei) 		no annotation 3 LEU A 703
TYR A 686
SER A 639
 None
 0.82A 5iktA-5h2rA:
undetectable		 5iktA-5h2rA:
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.
5hax NUCLEOPORIN NUP170

(Chaetomium
thermophilum) 		PF08801
(Nucleoporin_N) 		3 LEU A 462
TYR A 110
SER A 492
 None
 0.78A 5iktA-5haxA:
undetectable		 5iktA-5haxA:
20.61
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5ikr PROSTAGLANDIN G/H
SYNTHASE 2

(Homo sapiens) 		PF00008
(EGF)
PF03098
(An_peroxidase) 		3 LEU A 352
TYR A 385
SER A 530
 ID8  A 601 (-4.1A)
ID8  A 601 ( 3.5A)
ID8  A 601 (-2.7A)
 0.06A 5iktA-5ikrA:
64.6		 5iktA-5ikrA:
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.
5im3 RIBONUCLEOSIDE-DIPHO
SPHATE REDUCTASE

(Pseudomonas
aeruginosa) 		PF00317
(Ribonuc_red_lgN)
PF02867
(Ribonuc_red_lgC)
PF03477
(ATP-cone) 		3 LEU A 330
TYR A 353
SER A 356
 None
 0.89A 5iktA-5im3A:
0.0		 5iktA-5im3A:
20.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5j6p KINETOCHORE PROTEIN
MIS18

(Schizosaccharomyces
pombe) 		no annotation 3 LEU B  97
TYR B  45
SER B  67
 None
 0.86A 5iktA-5j6pB:
undetectable		 5iktA-5j6pB:
10.34
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.
5j8j HISTONE DEACETYLASE
HDA1

(Saccharomyces
cerevisiae) 		PF09757
(Arb2) 		3 LEU A 606
TYR A 599
SER A 646
 None
 0.88A 5iktA-5j8jA:
undetectable		 5iktA-5j8jA:
17.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5jr9 NEQ131

(Nanoarchaeum
equitans) 		PF01997
(Translin) 		3 LEU B 145
TYR B  92
SER B 126
 None
 0.77A 5iktA-5jr9B:
undetectable		 5iktA-5jr9B:
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.
5l7v GLYCOSIDE HYDROLASE

(Bacteroides
vulgatus) 		PF13320
(DUF4091) 		3 LEU A 462
TYR A 301
SER A 385
 None
 0.89A 5iktA-5l7vA:
undetectable		 5iktA-5l7vA:
21.86
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.
5lf7 PROTEASOME SUBUNIT
BETA TYPE-1

(Homo sapiens) 		PF00227
(Proteasome) 		3 LEU L  62
TYR L  44
SER L  40
 None
 0.86A 5iktA-5lf7L:
undetectable		 5iktA-5lf7L:
17.18
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.
5lxd DUAL SPECIFICITY
TYROSINE-PHOSPHORYLA
TION-REGULATED
KINASE 2

(Homo sapiens) 		PF00069
(Pkinase) 		3 LEU A 200
TYR A 301
SER A 299
 None
 0.79A 5iktA-5lxdA:
undetectable		 5iktA-5lxdA:
22.18
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.
5m5p PRE-MRNA-SPLICING
HELICASE BRR2

(Saccharomyces
cerevisiae) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF02889
(Sec63) 		3 LEU A1515
TYR A1777
SER A1480
 None
 0.61A 5iktA-5m5pA:
undetectable		 5iktA-5m5pA:
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.
5msc CARBOXYLIC ACID
REDUCTASE

(Nocardia
iowensis) 		PF00501
(AMP-binding) 		3 LEU A 465
TYR A 418
SER A 420
 None
AMP  A1201 (-4.9A)
None
 0.73A 5iktA-5mscA:
undetectable		 5iktA-5mscA:
17.58
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.
5na2 CAPSID PROTEIN (P24)

(Feline
immunodeficiency
virus) 		no annotation 3 LEU A 203
TYR A 153
SER A 182
 None
 0.89A 5iktA-5na2A:
undetectable		 5iktA-5na2A:
17.89
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.
5oms CYTOCHROME P450

(Amycolatopsis
sp. ATCC 39116) 		no annotation 3 LEU A  43
TYR A  28
SER A 294
 None
 0.64A 5iktA-5omsA:
undetectable		 5iktA-5omsA:
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.
5ori ALBUMIN

(Capra hircus) 		no annotation 3 LEU A 456
TYR A 410
SER A 488
 None
 0.90A 5iktA-5oriA:
1.3		 5iktA-5oriA:
20.89
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.
5veh KYNURENINE
AMINOTRANSFERASE

(Aedes aegypti) 		no annotation 3 LEU A 321
TYR A  49
SER A 258
 None
None
LLP  A 255 ( 4.3A)
 0.76A 5iktA-5vehA:
undetectable		 5iktA-5vehA:
22.09
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.
5veu CYTOCHROME P450 3A5

(Homo sapiens) 		no annotation 3 LEU A 211
TYR A 307
SER A 312
 None
 0.90A 5iktA-5veuA:
0.9		 5iktA-5veuA:
23.17
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.
5x2v L-METHIONINE
GAMMA-LYASE

(Pseudomonas
putida) 		PF01053
(Cys_Met_Meta_PP) 		3 LEU A 341
TYR A 114
SER A 208
 LLP  A 211 ( 4.6A)
LLP  A 211 ( 3.5A)
LLP  A 211 ( 2.7A)
 0.84A 5iktA-5x2vA:
undetectable		 5iktA-5x2vA:
20.89
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.
5yxe SERUM ALBUMIN

(Felis catus) 		no annotation 3 LEU A 457
TYR A 411
SER A 489
 None
 0.83A 5iktA-5yxeA:
undetectable		 5iktA-5yxeA:
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.
6btm ALTERNATIVE COMPLEX
III SUBUNIT B

(Flavobacterium
johnsoniae) 		no annotation 3 LEU B 502
TYR B 468
SER B 191
 None
 0.76A 5iktA-6btmB:
undetectable		 5iktA-6btmB:
undetectable