SIMILAR PATTERNS OF AMINO ACIDS FOR 6AP6_A_TLFA300_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.
1cb8 PROTEIN
(CHONDROITINASE AC)

(Pedobacter
heparinus) 		PF02278
(Lyase_8)
PF02884
(Lyase_8_C)
PF08124
(Lyase_8_N) 		5 PHE A 106
VAL A 105
VAL A 156
SER A 110
PHE A 113
 None
 1.36A 6ap6A-1cb8A:
undetectable		 6ap6A-1cb8A:
17.72
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.
1e2t N-HYDROXYARYLAMINE
O-ACETYLTRANSFERASE

(Salmonella
enterica) 		PF00797
(Acetyltransf_2) 		5 PHE A  38
ILE A  49
VAL A  43
PHE A 199
HIS A 107
 None
 1.16A 6ap6A-1e2tA:
undetectable		 6ap6A-1e2tA:
23.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1e2t N-HYDROXYARYLAMINE
O-ACETYLTRANSFERASE

(Salmonella
enterica) 		PF00797
(Acetyltransf_2) 		5 PHE A  38
VAL A 123
ILE A  49
VAL A  43
HIS A 107
 None
 1.30A 6ap6A-1e2tA:
undetectable		 6ap6A-1e2tA:
23.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1f9a HYPOTHETICAL PROTEIN
MJ0541

(Methanocaldococcus
jannaschii) 		PF01467
(CTP_transf_like) 		5 VAL A 102
PHE A   4
ILE A  30
PHE A   9
VAL A  95
 None
None
None
ATP  A 700 (-4.9A)
None
 1.34A 6ap6A-1f9aA:
undetectable		 6ap6A-1f9aA:
18.80
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.
1fok PROTEIN (FOKI
RESTRICTION
ENDONUCLEASE)

(Planomicrobium
okeanokoites) 		PF02980
(FokI_C)
PF02981
(FokI_N)
PF09254
(Endonuc-FokI_C)
PF16902
(Type2_restr_D3) 		5 VAL A 548
ILE A 453
VAL A 464
VAL A 428
PHE A 432
 None
 1.22A 6ap6A-1fokA:
undetectable		 6ap6A-1fokA:
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.
1iaw TYPE II RESTRICTION
ENZYME NAEI

(Lechevalieria
aerocolonigenes) 		PF09126
(NaeI) 		5 VAL A  35
PHE A  77
ILE A  89
VAL A  94
PHE A  79
 None
 1.32A 6ap6A-1iawA:
undetectable		 6ap6A-1iawA:
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.
1ksp PROTEIN (DNA
POLYMERASE I-KLENOW
FRAGMENT
(E.C.2.7.7.7))

(Escherichia
coli) 		PF00476
(DNA_pol_A)
PF01612
(DNA_pol_A_exo1) 		5 VAL A 896
PHE A 886
ILE A 540
VAL A 536
VAL A 874
 None
 1.26A 6ap6A-1kspA:
undetectable		 6ap6A-1kspA:
19.27
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.
1miq PLASMEPSIN

(Plasmodium
vivax) 		PF00026
(Asp) 		5 PHE A 259
PHE A 226
VAL A 211
PHE A 299
HIS A 200
 None
 1.18A 6ap6A-1miqA:
undetectable		 6ap6A-1miqA:
22.99
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.
1p32 MITOCHONDRIAL MATRIX
PROTEIN, SF2P32

(Homo sapiens) 		PF02330
(MAM33) 		5 VAL A 183
PHE A 204
TRP A 109
VAL A 169
PHE A 168
 None
 1.01A 6ap6A-1p32A:
undetectable		 6ap6A-1p32A:
18.42
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.
1q90 CYTOCHROME B6

(Chlamydomonas
reinhardtii) 		PF00033
(Cytochrome_B) 		5 VAL B 151
PHE B 183
VAL B 190
SER B 130
VAL B 133
 TDS  D 920 (-4.1A)
None
None
CLA  D 910 (-3.6A)
CLA  D 910 (-4.0A)
 0.88A 6ap6A-1q90B:
undetectable		 6ap6A-1q90B:
21.11
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.
1ujs ACTIN-BINDING LIM
PROTEIN HOMOLOGUE

(Homo sapiens) 		PF02209
(VHP)
PF16182
(AbLIM_anchor) 		5 PHE A  57
PHE A  64
ILE A  61
VAL A  56
PHE A  53
 None
 1.21A 6ap6A-1ujsA:
undetectable		 6ap6A-1ujsA:
17.02
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1wom SIGMA FACTOR SIGB
REGULATION PROTEIN
RSBQ

(Bacillus
subtilis) 		PF12697
(Abhydrolase_6) 		5 VAL A  33
PHE A  41
ILE A  21
VAL A  91
PHE A  23
 PGO  A 604 (-4.8A)
None
None
None
None
 1.36A 6ap6A-1womA:
39.6		 6ap6A-1womA:
38.97
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.
1yn9 POLYNUCLEOTIDE
5'-PHOSPHATASE

(Autographa
californica
multiple
nucleopolyhedrovirus) 		PF00782
(DSPc) 		5 VAL A 117
PHE A 149
ILE A 146
VAL A 163
VAL A 130
 None
 1.17A 6ap6A-1yn9A:
undetectable		 6ap6A-1yn9A:
21.58
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.
1z01 2-OXO-1,2-DIHYDROQUI
NOLINE
8-MONOOXYGENASE,
OXYGENASE COMPONENT

(Pseudomonas
putida) 		PF00355
(Rieske)
PF11723
(Aromatic_hydrox) 		5 VAL A  77
ILE A  63
VAL A 319
TRP A 329
VAL A 141
 None
 1.28A 6ap6A-1z01A:
undetectable		 6ap6A-1z01A:
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.
1zcj PEROXISOMAL
BIFUNCTIONAL ENZYME

(Rattus
norvegicus) 		PF00725
(3HCDH)
PF02737
(3HCDH_N) 		5 VAL A 325
PHE A 315
ILE A 320
VAL A 296
VAL A 323
 None
 1.27A 6ap6A-1zcjA:
undetectable		 6ap6A-1zcjA:
20.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1zs3 LACTOCOCCUS LACTIS
MG1363 DPSA

(Lactococcus
lactis) 		no annotation 5 PHE A  39
PHE A  93
VAL A  86
VAL A  69
PHE A  72
 None
 1.22A 6ap6A-1zs3A:
undetectable		 6ap6A-1zs3A:
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.
2ajh LEUCYL-TRNA
SYNTHETASE

(Escherichia
coli) 		PF13603
(tRNA-synt_1_2) 		5 PHE A 234
VAL A 236
VAL A 338
PHE A 253
VAL A 320
 None
None
MET  A 501 (-3.6A)
None
None
 1.19A 6ap6A-2ajhA:
undetectable		 6ap6A-2ajhA:
24.56
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.
2axc COLICIN E7

(Escherichia
coli) 		PF03515
(Cloacin) 		5 VAL A 180
PHE A 219
ILE A 267
VAL A 227
SER A 153
 None
None
None
None
GOL  A 401 (-2.8A)
 1.32A 6ap6A-2axcA:
undetectable		 6ap6A-2axcA:
22.36
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.
2hi0 PUTATIVE
PHOSPHOGLYCOLATE
PHOSPHATASE

(Lactobacillus
delbrueckii) 		PF13419
(HAD_2) 		5 VAL A 143
ILE A 187
VAL A 207
VAL A 130
PHE A   8
 None
 1.36A 6ap6A-2hi0A:
3.6		 6ap6A-2hi0A:
24.15
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.
2iik 3-KETOACYL-COA
THIOLASE,
PEROXISOMAL

(Homo sapiens) 		PF00108
(Thiolase_N)
PF02803
(Thiolase_C) 		5 VAL A 367
PHE A 203
ILE A 195
VAL A 189
VAL A 357
 None
 1.33A 6ap6A-2iikA:
undetectable		 6ap6A-2iikA:
22.01
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.
2kxv TELLURITE RESISTANCE
PROTEIN

(Klebsiella
pneumoniae) 		PF02342
(TerD) 		5 PHE A 139
VAL A  91
ILE A  75
VAL A   5
PHE A 151
 None
 1.29A 6ap6A-2kxvA:
undetectable		 6ap6A-2kxvA:
24.91
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.
2mmy TATA-BINDING
PROTEIN-ASSOCIATED
FACTOR 2N

(Homo sapiens) 		PF00076
(RRM_1) 		5 PHE A 253
PHE A 290
ILE A 236
VAL A 315
PHE A 303
 None
 1.28A 6ap6A-2mmyA:
undetectable		 6ap6A-2mmyA:
15.79
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.
2p5x N-ACETYLSEROTONIN
O-METHYLTRANSFERASE-
LIKE PROTEIN

(Homo sapiens) 		PF02545
(Maf) 		5 PHE A  35
ILE A  85
VAL A 125
SER A  19
VAL A  37
 None
None
None
PO4  A 301 (-2.3A)
None
 0.91A 6ap6A-2p5xA:
undetectable		 6ap6A-2p5xA:
21.00
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.
2r0h CGL3 LECTIN

(Coprinopsis
cinerea) 		PF00337
(Gal-bind_lectin) 		5 PHE A  70
ILE A  61
VAL A  48
PHE A 145
VAL A 119
 None
 1.34A 6ap6A-2r0hA:
undetectable		 6ap6A-2r0hA:
22.68
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.
2r77 PHOSPHATIDYLETHANOLA
MINE-BINDING
PROTEIN, PUTATIVE

(Plasmodium
falciparum) 		PF01161
(PBP) 		5 VAL A  44
PHE A  35
VAL A 185
SER A 152
VAL A 197
 None
 1.34A 6ap6A-2r77A:
undetectable		 6ap6A-2r77A:
21.09
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.
2vga PROTEIN A41

(Vaccinia virus) 		PF02250
(Orthopox_35kD) 		5 VAL A  44
ILE A  16
VAL A 160
VAL A  65
PHE A  62
 None
 1.21A 6ap6A-2vgaA:
undetectable		 6ap6A-2vgaA:
18.66
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.
2x58 PEROXISOMAL
BIFUNCTIONAL ENZYME

(Rattus
norvegicus) 		PF00378
(ECH_1)
PF00725
(3HCDH)
PF02737
(3HCDH_N) 		5 VAL A 325
PHE A 315
ILE A 320
VAL A 296
VAL A 323
 None
 1.28A 6ap6A-2x58A:
undetectable		 6ap6A-2x58A:
17.19
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.
2xhe UNC18

(Monosiga
brevicollis) 		PF00995
(Sec1) 		6 VAL A  54
PHE A 100
ILE A 128
VAL A  10
VAL A  29
PHE A  72
 None
 1.50A 6ap6A-2xheA:
2.8		 6ap6A-2xheA:
18.45
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.
2z0m 337AA LONG
HYPOTHETICAL
ATP-DEPENDENT RNA
HELICASE DEAD

(Sulfurisphaera
tokodaii) 		PF00270
(DEAD)
PF00271
(Helicase_C) 		5 PHE A 226
VAL A 227
PHE A 262
ILE A 259
SER A 277
 None
 1.33A 6ap6A-2z0mA:
undetectable		 6ap6A-2z0mA:
22.51
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.
3cfx UPF0100 PROTEIN
MA_0280

(Methanosarcina
acetivorans) 		PF13531
(SBP_bac_11) 		5 VAL A  53
PHE A 118
PHE A 311
PHE A 324
HIS A  47
 None
 1.12A 6ap6A-3cfxA:
undetectable		 6ap6A-3cfxA:
20.19
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.
3dgt ENDO-1,3-BETA-GLUCAN
ASE

(Streptomyces
sioyaensis) 		PF00722
(Glyco_hydro_16) 		5 PHE A  13
VAL A 102
ILE A  85
VAL A  25
VAL A 238
 None
 1.33A 6ap6A-3dgtA:
undetectable		 6ap6A-3dgtA:
20.07
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.
3h09 IMMUNOGLOBULIN A1
PROTEASE

(Haemophilus
influenzae) 		PF02395
(Peptidase_S6)
PF03212
(Pertactin) 		5 VAL A 868
ILE A 783
VAL A 821
VAL A 852
PHE A 833
 None
 1.24A 6ap6A-3h09A:
undetectable		 6ap6A-3h09A:
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.
3ibz PUTATIVE TELLURIUM
RESISTANT LIKE
PROTEIN TERD

(Streptomyces
coelicolor) 		PF02342
(TerD) 		5 PHE A 157
VAL A 109
ILE A  93
VAL A  23
PHE A 169
 None
 1.18A 6ap6A-3ibzA:
undetectable		 6ap6A-3ibzA:
22.56
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.
3ihk THIAMIN
PYROPHOSPHOKINASE

(Streptococcus
mutans) 		PF04263
(TPK_catalytic)
PF04265
(TPK_B1_binding) 		5 VAL A 133
PHE A 194
ILE A 164
PHE A 187
PHE A 154
 None
 1.32A 6ap6A-3ihkA:
undetectable		 6ap6A-3ihkA:
23.91
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.
3one ADENOSYLHOMOCYSTEINA
SE

(Lupinus luteus) 		PF00670
(AdoHcyase_NAD)
PF05221
(AdoHcyase) 		5 VAL A 314
PHE A 321
ILE A 344
VAL A 258
VAL A 266
 None
 1.37A 6ap6A-3oneA:
4.0		 6ap6A-3oneA:
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.
3p4x REVERSE GYRASE
HELICASE-LIKE DOMAIN

(Thermotoga
maritima) 		PF00270
(DEAD)
PF00271
(Helicase_C) 		5 PHE A 109
PHE A 199
VAL A  91
PHE A  67
VAL A 254
 None
 1.23A 6ap6A-3p4xA:
undetectable		 6ap6A-3p4xA:
20.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3pr6 TRAPP-ASSOCIATED
PROTEIN TCA17

(Saccharomyces
cerevisiae) 		PF04628
(Sedlin_N) 		5 PHE A  90
VAL A  72
PHE A   7
VAL A 112
PHE A 109
 None
CSO  A   6 ( 4.5A)
None
None
None
 1.30A 6ap6A-3pr6A:
undetectable		 6ap6A-3pr6A:
22.43
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.
3pxg NEGATIVE REGULATOR
OF GENETIC
COMPETENCE CLPC/MECB

(Bacillus
subtilis) 		PF00004
(AAA)
PF02151
(UVR)
PF02861
(Clp_N) 		5 ILE A 476
VAL A 479
TRP A 483
SER A 378
VAL A 375
 None
 1.30A 6ap6A-3pxgA:
undetectable		 6ap6A-3pxgA:
21.89
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.
3qmq AUTOINDUCER-2 (AI-2)
MODIFYING PROTEIN
LSRG

(Escherichia
coli) 		PF03992
(ABM) 		5 PHE A  38
ILE A  52
VAL A   6
VAL A  21
PHE A  22
 None
 1.21A 6ap6A-3qmqA:
undetectable		 6ap6A-3qmqA:
17.06
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3qvm OLEI00960

(Oleispira
antarctica) 		PF00561
(Abhydrolase_1) 		5 PHE A  36
VAL A 106
PHE A 134
PHE A 145
TRP A 164
 None
 0.84A 6ap6A-3qvmA:
37.8		 6ap6A-3qvmA:
31.58
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.
3rpx COMPLEMENT COMPONENT
1 Q
SUBCOMPONENT-BINDING
PROTEIN

(Homo sapiens) 		PF02330
(MAM33) 		5 VAL A 183
PHE A 204
TRP A 109
VAL A 169
PHE A 168
 None
UNX  A  60 ( 4.7A)
None
None
None
 1.03A 6ap6A-3rpxA:
undetectable		 6ap6A-3rpxA:
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.
3s38 CYTOCHROME C OXIDASE
SUBUNIT 2

(Thermus
thermophilus) 		PF00116
(COX2)
PF09125
(COX2-transmemb) 		5 PHE B 116
VAL B 125
ILE B 103
VAL B  97
VAL B 135
 None
 1.19A 6ap6A-3s38B:
undetectable		 6ap6A-3s38B:
20.54
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.
3s38 CYTOCHROME C OXIDASE
SUBUNIT 2

(Thermus
thermophilus) 		PF00116
(COX2)
PF09125
(COX2-transmemb) 		5 VAL B 125
PHE B 139
ILE B 103
VAL B  97
VAL B 135
 None
 1.33A 6ap6A-3s38B:
undetectable		 6ap6A-3s38B:
20.54
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.
3td9 BRANCHED CHAIN AMINO
ACID ABC
TRANSPORTER,
PERIPLASMIC AMINO
ACID-BINDING PROTEIN

(Thermotoga
maritima) 		PF13458
(Peripla_BP_6) 		5 VAL A 185
ILE A 224
PHE A 233
VAL A 158
PHE A 159
 None
 1.24A 6ap6A-3td9A:
3.0		 6ap6A-3td9A:
20.32
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3w04 DWARF 88 ESTERASE

(Oryza sativa) 		PF12697
(Abhydrolase_6) 		7 PHE A  78
VAL A 148
PHE A 186
ILE A 191
VAL A 194
PHE A 245
HIS A 297
 MPD  A 401 ( 4.4A)
None
None
None
None
MPD  A 401 ( 4.4A)
None
 0.82A 6ap6A-3w04A:
45.6		 6ap6A-3w04A:
75.09
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3w04 DWARF 88 ESTERASE

(Oryza sativa) 		PF12697
(Abhydrolase_6) 		7 PHE A  78
VAL A 148
PHE A 186
ILE A 191
VAL A 244
PHE A 245
HIS A 297
 MPD  A 401 ( 4.4A)
None
None
None
MPD  A 401 ( 4.8A)
MPD  A 401 ( 4.4A)
None
 0.75A 6ap6A-3w04A:
45.6		 6ap6A-3w04A:
75.09
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3w04 DWARF 88 ESTERASE

(Oryza sativa) 		PF12697
(Abhydrolase_6) 		7 PHE A  78
VAL A 148
PHE A 186
TRP A 205
VAL A 244
PHE A 245
HIS A 297
 MPD  A 401 ( 4.4A)
None
None
None
MPD  A 401 ( 4.8A)
MPD  A 401 ( 4.4A)
None
 0.52A 6ap6A-3w04A:
45.6		 6ap6A-3w04A:
75.09
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3w04 DWARF 88 ESTERASE

(Oryza sativa) 		PF12697
(Abhydrolase_6) 		7 PHE A  78
VAL A 148
PHE A 186
VAL A 194
TRP A 205
PHE A 245
HIS A 297
 MPD  A 401 ( 4.4A)
None
None
None
None
MPD  A 401 ( 4.4A)
None
 0.61A 6ap6A-3w04A:
45.6		 6ap6A-3w04A:
75.09
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3w04 DWARF 88 ESTERASE

(Oryza sativa) 		PF12697
(Abhydrolase_6) 		7 VAL A 148
PHE A 176
PHE A 186
ILE A 191
VAL A 194
PHE A 245
HIS A 297
 None
MPD  A 401 ( 3.7A)
None
None
None
MPD  A 401 ( 4.4A)
None
 0.93A 6ap6A-3w04A:
45.6		 6ap6A-3w04A:
75.09
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3w04 DWARF 88 ESTERASE

(Oryza sativa) 		PF12697
(Abhydrolase_6) 		7 VAL A 148
PHE A 176
PHE A 186
ILE A 191
VAL A 244
PHE A 245
HIS A 297
 None
MPD  A 401 ( 3.7A)
None
None
MPD  A 401 ( 4.8A)
MPD  A 401 ( 4.4A)
None
 0.90A 6ap6A-3w04A:
45.6		 6ap6A-3w04A:
75.09
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3w04 DWARF 88 ESTERASE

(Oryza sativa) 		PF12697
(Abhydrolase_6) 		7 VAL A 148
PHE A 176
PHE A 186
TRP A 205
VAL A 244
PHE A 245
HIS A 297
 None
MPD  A 401 ( 3.7A)
None
None
MPD  A 401 ( 4.8A)
MPD  A 401 ( 4.4A)
None
 0.72A 6ap6A-3w04A:
45.6		 6ap6A-3w04A:
75.09
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3w04 DWARF 88 ESTERASE

(Oryza sativa) 		PF12697
(Abhydrolase_6) 		7 VAL A 148
PHE A 176
PHE A 186
VAL A 194
TRP A 205
PHE A 245
HIS A 297
 None
MPD  A 401 ( 3.7A)
None
None
None
MPD  A 401 ( 4.4A)
None
 0.77A 6ap6A-3w04A:
45.6		 6ap6A-3w04A:
75.09
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.
3wks O-PHOSPHO-L-SERYL-TR
NA:CYS-TRNA SYNTHASE

(Methanocaldococcus
jannaschii) 		PF05889
(SepSecS) 		5 VAL A 373
PHE A 349
ILE A 391
VAL A 392
VAL A 384
 None
 1.30A 6ap6A-3wksA:
2.2		 6ap6A-3wksA:
19.71
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.
3zef PRE-MRNA-SPLICING
FACTOR 8

(Saccharomyces
cerevisiae) 		PF08084
(PROCT)
PF10596
(U6-snRNA_bdg)
PF10597
(U5_2-snRNA_bdg)
PF10598
(RRM_4)
PF12134
(PRP8_domainIV) 		5 PHE B1312
PHE B1441
ILE B1440
TRP B1335
PHE B1343
 None
 1.13A 6ap6A-3zefB:
undetectable		 6ap6A-3zefB:
11.26
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.
4arc LEUCINE--TRNA LIGASE

(Escherichia
coli) 		PF00133
(tRNA-synt_1)
PF08264
(Anticodon_1)
PF13603
(tRNA-synt_1_2) 		5 PHE A 234
VAL A 236
VAL A 338
PHE A 253
VAL A 320
 None
 1.19A 6ap6A-4arcA:
undetectable		 6ap6A-4arcA:
15.27
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.
4bh5 MUREIN HYDROLASE
ACTIVATOR ENVC

(Escherichia
coli) 		PF01551
(Peptidase_M23) 		5 VAL A 341
PHE A 402
VAL A 302
VAL A 354
HIS A 358
 None
 1.32A 6ap6A-4bh5A:
undetectable		 6ap6A-4bh5A:
20.82
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.
4cab CATALASE

(Deinococcus
radiodurans) 		PF00199
(Catalase)
PF06628
(Catalase-rel) 		5 PHE A 111
VAL A  97
VAL A 145
PHE A  91
VAL A 292
 None
 1.26A 6ap6A-4cabA:
undetectable		 6ap6A-4cabA:
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.
4cyf PANTETHEINASE

(Homo sapiens) 		PF00795
(CN_hydrolase) 		5 VAL A 224
PHE A 234
PHE A 250
VAL A 260
PHE A 262
 None
CSO  A 211 ( 4.0A)
None
None
None
 1.30A 6ap6A-4cyfA:
undetectable		 6ap6A-4cyfA:
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.
4dlo BRAIN-SPECIFIC
ANGIOGENESIS
INHIBITOR 3

(Homo sapiens) 		PF01825
(GPS)
PF02793
(HRM)
PF16489
(GAIN) 		5 VAL A 620
PHE A 630
ILE A 684
VAL A 685
VAL A 677
 None
 1.10A 6ap6A-4dloA:
undetectable		 6ap6A-4dloA:
19.75
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.
4gb5 UNCHARACTERIZED
PROTEIN

(Kribbella
flavida) 		PF13577
(SnoaL_4) 		5 VAL A 114
ILE A  40
VAL A  45
PHE A  42
HIS A  74
 None
 1.27A 6ap6A-4gb5A:
undetectable		 6ap6A-4gb5A:
20.22
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.
4h0c PHOSPHOLIPASE/CARBOX
YLESTERASE

(Dyadobacter
fermentans) 		PF02230
(Abhydrolase_2) 		5 VAL A 171
ILE A 205
VAL A 201
SER A 182
VAL A 181
 None
 1.34A 6ap6A-4h0cA:
12.9		 6ap6A-4h0cA:
24.16
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.
4hcj THIJ/PFPI DOMAIN
PROTEIN

(Brachyspira
murdochii) 		PF01965
(DJ-1_PfpI) 		5 VAL A 169
ILE A 104
VAL A  73
VAL A 151
PHE A 162
 None
 1.35A 6ap6A-4hcjA:
2.7		 6ap6A-4hcjA:
21.54
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.
4ip3 ORF169B

(Shigella
flexneri) 		no annotation 5 VAL A 181
PHE A 167
PHE A 158
ILE A 138
VAL A 189
 None
 1.10A 6ap6A-4ip3A:
undetectable		 6ap6A-4ip3A:
19.71
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.
4iq4 NON-HAEM
BROMOPEROXIDASE
BPO-A2, MATRIX
PROTEIN 1

(Kitasatospora
aureofaciens;
Influenza A
virus) 		PF00561
(Abhydrolase_1)
PF00598
(Flu_M1) 		5 VAL A 294
ILE A 414
VAL A 421
VAL A 346
PHE A 345
 None
 1.23A 6ap6A-4iq4A:
32.0		 6ap6A-4iq4A:
22.25
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.
4jcm CYCLODEXTRIN
GLUCANOTRANSFERASE

([Bacillus]
clarkii) 		PF00128
(Alpha-amylase)
PF00686
(CBM_20)
PF01833
(TIG) 		5 VAL A 660
PHE A 578
ILE A 609
SER A 628
VAL A 576
 None
 1.27A 6ap6A-4jcmA:
undetectable		 6ap6A-4jcmA:
17.00
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.
4jh8 METALLOTHIOL
TRANSFERASE FOSB

(Bacillus cereus) 		PF00903
(Glyoxalase) 		5 VAL A  88
PHE A  69
ILE A  42
VAL A  47
VAL A  25
 None
 1.18A 6ap6A-4jh8A:
undetectable		 6ap6A-4jh8A:
17.04
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4jyp HYDROLASE,
ALPHA/BETA FOLD
FAMILY PROTEIN

(Arabidopsis
thaliana) 		PF12697
(Abhydrolase_6) 		6 PHE A  26
VAL A  96
PHE A 134
TRP A 153
PHE A 157
HIS A 246
 None
 0.51A 6ap6A-4jypA:
43.2		 6ap6A-4jypA:
54.24
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4jyp HYDROLASE,
ALPHA/BETA FOLD
FAMILY PROTEIN

(Arabidopsis
thaliana) 		PF12697
(Abhydrolase_6) 		5 PHE A  26
VAL A  96
PHE A 134
TRP A 153
PHE A 194
 None
 1.06A 6ap6A-4jypA:
43.2		 6ap6A-4jypA:
54.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4kly BLUE-LIGHT ABSORBING
PROTEORHODOPSIN

(gamma
proteobacterium
'Hot 75m4') 		PF01036
(Bac_rhodopsin) 		5 VAL A 107
PHE A 235
VAL A 242
SER A  61
VAL A  64
 None
 1.27A 6ap6A-4klyA:
undetectable		 6ap6A-4klyA:
24.08
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.
4mnn GLUTAREDOXIN RELATED
PROTEIN

(Sulfolobus
solfataricus) 		PF13192
(Thioredoxin_3) 		5 VAL A  52
PHE A  30
ILE A   7
VAL A   6
PHE A  33
 None
 1.30A 6ap6A-4mnnA:
undetectable		 6ap6A-4mnnA:
19.85
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.
4om9 SERINE PROTEASE PET

(Escherichia
coli) 		PF02395
(Peptidase_S6) 		5 ILE A 303
VAL A 326
PHE A 336
VAL A 296
PHE A 297
 None
 1.08A 6ap6A-4om9A:
undetectable		 6ap6A-4om9A:
13.66
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.
4ono BETA-2-MICROGLOBULIN
/T-CELL SURFACE
GLYCOPROTEIN
CD1C/T-CELL SURFACE
GLYCOPROTEIN CD1B
CHIMERIC PROTEIN

(Homo sapiens) 		PF07654
(C1-set)
PF16497
(MHC_I_3) 		5 VAL A  37
PHE A  30
PHE A  62
TRP A 146
VAL A  27
 None
 1.33A 6ap6A-4onoA:
undetectable		 6ap6A-4onoA:
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.
4poi PUTATIVE PERIPLASMIC
PROTEIN

(Bacteroides
caccae) 		PF11396
(PepSY_like) 		5 PHE A 137
PHE A 139
VAL A  99
VAL A 135
HIS A 110
 None
 1.19A 6ap6A-4poiA:
undetectable		 6ap6A-4poiA:
20.36
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.
4qg5 PUTATIVE
PHOSPHOGLUCOMUTASE

(Leishmania
major) 		PF00408
(PGM_PMM_IV)
PF02878
(PGM_PMM_I)
PF02879
(PGM_PMM_II)
PF02880
(PGM_PMM_III) 		5 PHE A 234
VAL A 240
ILE A 307
VAL A 217
PHE A 294
 None
 1.32A 6ap6A-4qg5A:
undetectable		 6ap6A-4qg5A:
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.
4rev DISEASE RESISTANCE
RESPONSE PROTEIN 206

(Pisum sativum) 		PF03018
(Dirigent) 		5 VAL A 145
PHE A 115
PHE A  38
ILE A  83
PHE A 117
 GOL  A 201 (-3.9A)
None
None
None
None
 1.36A 6ap6A-4revA:
undetectable		 6ap6A-4revA:
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.
4rh7 GREEN FLUORESCENT
PROTEIN/CYTOPLASMIC
DYNEIN 2 HEAVY CHAIN
1

(Homo sapiens;
synthetic
construct) 		PF03028
(Dynein_heavy)
PF07728
(AAA_5)
PF08393
(DHC_N2)
PF12774
(AAA_6)
PF12775
(AAA_7)
PF12777
(MT)
PF12780
(AAA_8)
PF12781
(AAA_9) 		5 VAL A1610
PHE A1632
ILE A1545
VAL A1551
HIS A1605
 None
 1.22A 6ap6A-4rh7A:
undetectable		 6ap6A-4rh7A:
5.88
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.
4tkx LYS-GINGIPAIN W83

(Porphyromonas
gingivalis) 		PF01364
(Peptidase_C25)
PF03785
(Peptidase_C25_C) 		5 PHE L 347
VAL L 587
VAL L 242
SER L 592
VAL L 553
 None
 1.28A 6ap6A-4tkxL:
undetectable		 6ap6A-4tkxL:
19.69
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.
4u1d EUKARYOTIC
TRANSLATION
INITIATION FACTOR 3
SUBUNIT A

(Saccharomyces
cerevisiae) 		no annotation 5 PHE C 433
VAL C 434
PHE C 491
ILE C 482
VAL C 478
 None
 1.22A 6ap6A-4u1dC:
undetectable		 6ap6A-4u1dC:
19.55
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.
4yzg PROTEIN PHOSPHATASE
2C 57

(Arabidopsis
thaliana) 		PF00481
(PP2C) 		5 VAL A 232
PHE A 138
SER A 161
PHE A 236
HIS A 177
 None
 1.03A 6ap6A-4yzgA:
undetectable		 6ap6A-4yzgA:
26.09
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.
4z23 CELL WALL SURFACE
ANCHOR PROTEIN

(Streptococcus
agalactiae) 		PF16364
(Antigen_C) 		5 PHE A 290
VAL A 208
PHE A 312
PHE A 221
VAL A 314
 None
 1.26A 6ap6A-4z23A:
undetectable		 6ap6A-4z23A:
21.31
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.
4zm4 AMINOTRANSFERASE

(Streptomyces
pactum) 		PF00202
(Aminotran_3) 		5 VAL A 124
VAL A 318
SER A 275
VAL A 273
HIS A 304
 None
None
PLP  A 501 ( 4.9A)
None
None
 1.19A 6ap6A-4zm4A:
undetectable		 6ap6A-4zm4A:
23.89
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5dnw SHKAI2IB

(Striga
hermonthica) 		PF12697
(Abhydrolase_6) 		7 PHE A  26
PHE A 124
PHE A 134
TRP A 153
PHE A 157
PHE A 194
HIS A 246
 None
 0.87A 6ap6A-5dnwA:
38.3		 6ap6A-5dnwA:
53.31
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.
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo sapiens) 		PF00117
(GATase)
PF00988
(CPSase_sm_chain)
PF02142
(MGS)
PF02786
(CPSase_L_D2)
PF02787
(CPSase_L_D3) 		5 PHE A 291
ILE A 406
VAL A 409
VAL A 374
PHE A 372
 None
 1.28A 6ap6A-5dotA:
undetectable		 6ap6A-5dotA:
11.11
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.
5h7t CLASS IV CHITINASE

(Cryptomeria
japonica) 		no annotation 5 PHE A  59
ILE A  56
VAL A   6
PHE A  11
VAL A 142
 None
 1.22A 6ap6A-5h7tA:
undetectable		 6ap6A-5h7tA:
21.68
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5hzg STRIGOLACTONE
ESTERASE D14

(Arabidopsis
thaliana) 		PF12697
(Abhydrolase_6) 		5 VAL A  98
PHE A 126
PHE A 136
ILE A 141
VAL A 144
 6OM  A 301 (-3.0A)
None
None
None
None
 1.01A 6ap6A-5hzgA:
34.0		 6ap6A-5hzgA:
81.34
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5hzg STRIGOLACTONE
ESTERASE D14

(Arabidopsis
thaliana) 		PF12697
(Abhydrolase_6) 		6 VAL A  98
PHE A 126
PHE A 136
ILE A 141
VAL A 194
HIS A 247
 6OM  A 301 (-3.0A)
None
None
None
None
6OM  A 301 (-2.6A)
 1.33A 6ap6A-5hzgA:
34.0		 6ap6A-5hzgA:
81.34
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5hzg STRIGOLACTONE
ESTERASE D14

(Arabidopsis
thaliana) 		PF12697
(Abhydrolase_6) 		6 VAL A  98
PHE A 136
ILE A 141
SER A 191
PHE A 195
HIS A 247
 6OM  A 301 (-3.0A)
None
None
None
None
6OM  A 301 (-2.6A)
 1.15A 6ap6A-5hzgA:
34.0		 6ap6A-5hzgA:
81.34
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5hzg STRIGOLACTONE
ESTERASE D14

(Arabidopsis
thaliana) 		PF12697
(Abhydrolase_6) 		6 VAL A  98
PHE A 136
ILE A 141
SER A 191
VAL A 194
HIS A 247
 6OM  A 301 (-3.0A)
None
None
None
None
6OM  A 301 (-2.6A)
 1.25A 6ap6A-5hzgA:
34.0		 6ap6A-5hzgA:
81.34
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5hzg STRIGOLACTONE
ESTERASE D14

(Arabidopsis
thaliana) 		PF12697
(Abhydrolase_6) 		5 VAL A  98
PHE A 136
ILE A 141
VAL A 144
PHE A 195
 6OM  A 301 (-3.0A)
None
None
None
None
 1.14A 6ap6A-5hzgA:
34.0		 6ap6A-5hzgA:
81.34
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.
5i4e MYOSIN-14,ALPHA-ACTI
NIN A

(Homo sapiens;
Dictyostelium
discoideum) 		PF00063
(Myosin_head)
PF00435
(Spectrin)
PF02736
(Myosin_N) 		5 PHE A 741
ILE A 785
VAL A 780
VAL A 791
PHE A 787
 None
 1.20A 6ap6A-5i4eA:
undetectable		 6ap6A-5i4eA:
14.41
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.
5ihr PROBABLE
BETA-GALACTOSIDASE A

(Aspergillus
niger) 		PF01301
(Glyco_hydro_35)
PF10435
(BetaGal_dom2)
PF13363
(BetaGal_dom3)
PF13364
(BetaGal_dom4_5) 		5 ILE A 555
VAL A 525
SER A 535
VAL A 543
HIS A 512
 None
None
NAG  A1522 ( 4.6A)
None
None
 1.08A 6ap6A-5ihrA:
undetectable		 6ap6A-5ihrA:
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.
5lhs UROKINASE-TYPE
PLASMINOGEN
ACTIVATOR

(Mus musculus) 		no annotation 5 PHE B  30
ILE B 212
VAL B 213
TRP B 215
VAL B  52
 None
 1.32A 6ap6A-5lhsB:
undetectable		 6ap6A-5lhsB:
22.97
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.
5n2i REDUCED COENZYME
F420:NADP
OXIDOREDUCTASE

(Thermobifida
fusca) 		PF03807
(F420_oxidored) 		5 VAL A 147
ILE A 190
VAL A 193
VAL A 183
HIS A 151
 None
 1.22A 6ap6A-5n2iA:
undetectable		 6ap6A-5n2iA:
24.40
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.
5nag KYNURENINE
3-MONOOXYGENASE

(Pseudomonas
fluorescens) 		PF01494
(FAD_binding_3) 		5 PHE A 253
PHE A 265
PHE A 270
VAL A 235
PHE A 266
 None
 1.30A 6ap6A-5nagA:
undetectable		 6ap6A-5nagA:
22.56
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.
5ok4 5,10-METHENYLTETRAHY
DROMETHANOPTERIN
HYDROGENASE

(Methanothermobacter
marburgensis) 		no annotation 5 PHE A  70
ILE A 127
VAL A  65
PHE A  66
HIS A  41
 None
None
FEG  A 404 ( 4.9A)
None
None
 1.08A 6ap6A-5ok4A:
undetectable		 6ap6A-5ok4A:
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.
5wlp AUTOPHAGY-RELATED
PROTEIN 32

(Saccharomyces
cerevisiae) 		no annotation 5 PHE A  66
PHE A  56
ILE A  79
VAL A  88
VAL A  73
 None
 1.36A 6ap6A-5wlpA:
undetectable		 6ap6A-5wlpA:
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.
5z24 PILUS ASSEMBLY
PROTEIN

(Lactobacillus
rhamnosus) 		no annotation 5 PHE A 238
ILE A 264
VAL A 259
PHE A 216
VAL A 305
 None
 1.35A 6ap6A-5z24A:
undetectable		 6ap6A-5z24A:
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.
6ap6 PROBABLE
STRIGOLACTONE
ESTERASE DAD2

(Petunia x
hybrida) 		no annotation 12 PHE A  27
VAL A  97
PHE A 125
PHE A 135
ILE A 140
VAL A 143
TRP A 154
PHE A 158
SER A 190
VAL A 193
PHE A 194
HIS A 246
 TLF  A 300 (-3.8A)
TLF  A 300 ( 4.4A)
TLF  A 300 (-4.7A)
TLF  A 300 ( 4.5A)
None
None
None
TLF  A 300 (-4.6A)
TLF  A 300 (-3.4A)
TLF  A 300 (-4.1A)
TLF  A 300 (-4.8A)
TLF  A 300 (-3.9A)
 0.00A 6ap6A-6ap6A:
51.5		 6ap6A-6ap6A:
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.
6ap6 PROBABLE
STRIGOLACTONE
ESTERASE DAD2

(Petunia x
hybrida) 		no annotation 5 PHE A 194
VAL A 143
TRP A 154
PHE A 158
VAL A 189
 TLF  A 300 (-4.8A)
None
None
TLF  A 300 (-4.6A)
None
 1.11A 6ap6A-6ap6A:
51.5		 6ap6A-6ap6A:
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.
6h20 -

(-) 		no annotation 5 PHE A 131
PHE A 290
ILE A 158
VAL A  96
VAL A  85
 None
 1.09A 6ap6A-6h20A:
undetectable		 6ap6A-6h20A:
undetectable