SIMILAR PATTERNS OF AMINO ACIDS FOR 4OK1_A_198A1001

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.
1jhd SULFATE
ADENYLYLTRANSFERASE

(Sulfur-oxidizing
endosymbiont of
Riftia
pachyptila) 		PF01747
(ATP-sulfurylase)
PF14306
(PUA_2) 		6 LEU A 230
LEU A 229
GLN A 199
VAL A 226
ARG A 284
ILE A 238
 None
None
BR  A2008 (-4.0A)
None
None
None
 1.42A 4ok1A-1jhdA:
undetectable		 4ok1A-1jhdA:
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.
1kng THIOL:DISULFIDE
INTERCHANGE PROTEIN
CYCY

(Bradyrhizobium
japonicum) 		PF08534
(Redoxin) 		5 LEU A 102
LEU A 105
GLY A 106
VAL A  85
VAL A  70
 None
 1.00A 4ok1A-1kngA:
undetectable		 4ok1A-1kngA:
22.80
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.
1qni NITROUS-OXIDE
REDUCTASE

(Marinobacter
hydrocarbonoclasticus) 		no annotation 5 LEU A 299
LEU A 302
VAL A 223
ILE A 231
VAL A 181
 None
 1.17A 4ok1A-1qniA:
0.0		 4ok1A-1qniA:
17.80
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.
1rpn GDP-MANNOSE
4,6-DEHYDRATASE

(Pseudomonas
aeruginosa) 		PF16363
(GDP_Man_Dehyd) 		5 LEU A 132
GLY A 131
LEU A 286
ILE A 176
VAL A 243
 None
 1.13A 4ok1A-1rpnA:
0.0		 4ok1A-1rpnA:
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.
1to6 GLYCERATE KINASE

(Neisseria
meningitidis) 		PF02595
(Gly_kinase) 		5 LEU A 238
GLY A 240
VAL A 260
ILE A 247
VAL A  88
 None
 1.01A 4ok1A-1to6A:
0.0		 4ok1A-1to6A:
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.
1w5e FTSZ

(Methanocaldococcus
jannaschii) 		PF00091
(Tubulin)
PF12327
(FtsZ_C) 		5 LEU A 131
GLY A 130
LEU A 215
VAL A 188
ILE A  53
 None
GTP  A 500 (-3.5A)
None
None
None
 1.15A 4ok1A-1w5eA:
0.0		 4ok1A-1w5eA:
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.
1weh CONSERVED
HYPOTHETICAL PROTEIN
TT1887

(Thermus
thermophilus) 		PF03641
(Lysine_decarbox) 		5 LEU A   4
LEU A  36
GLY A  35
VAL A  28
MET A   1
 None
 1.01A 4ok1A-1wehA:
undetectable		 4ok1A-1wehA:
19.92
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.
1wjr KIAA1617 PROTEIN

(Homo sapiens) 		PF02820
(MBT) 		5 LEU A 110
LEU A  44
VAL A  14
ILE A  31
VAL A  47
 None
 1.16A 4ok1A-1wjrA:
undetectable		 4ok1A-1wjrA:
19.11
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.
1wz8 ENOYL-COA HYDRATASE

(Thermus
thermophilus) 		PF00378
(ECH_1) 		5 LEU A 120
GLY A 119
LEU A  96
MET A  34
VAL A  89
 None
 1.16A 4ok1A-1wz8A:
0.0		 4ok1A-1wz8A:
22.60
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.
1xb7 STEROID HORMONE
RECEPTOR ERR1

(Homo sapiens) 		PF00104
(Hormone_recep) 		5 LEU A 324
LEU A 327
MET A 362
VAL A 366
ARG A 372
 None
 0.52A 4ok1A-1xb7A:
26.2		 4ok1A-1xb7A:
23.53
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.
1xnf LIPOPROTEIN NLPI

(Escherichia
coli) 		PF07719
(TPR_2)
PF13181
(TPR_8) 		5 LEU A 256
LEU A 259
LEU A 219
MET A 216
ILE A 202
 None
 1.12A 4ok1A-1xnfA:
0.0		 4ok1A-1xnfA:
21.40
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.
1zo1 TRANSLATION
INITIATION FACTOR 2

(Escherichia
coli) 		PF00009
(GTP_EFTU)
PF03144
(GTP_EFTU_D2)
PF11987
(IF-2) 		5 LEU I 454
GLY I 466
GLN I 451
ARG I 414
ILE I 460
 None
 1.09A 4ok1A-1zo1I:
undetectable		 4ok1A-1zo1I:
19.48
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2ax9 ANDROGEN RECEPTOR

(Homo sapiens) 		PF00104
(Hormone_recep) 		11 LEU A 704
LEU A 707
GLY A 708
GLN A 711
MET A 742
VAL A 746
ARG A 752
THR A 877
MET A 895
ILE A 899
VAL A 903
 BHM  A   1 (-4.0A)
BHM  A   1 ( 4.2A)
BHM  A   1 ( 3.8A)
BHM  A   1 (-2.2A)
BHM  A   1 ( 4.0A)
BHM  A   1 (-3.6A)
BHM  A   1 (-3.8A)
BHM  A   1 (-3.0A)
None
None
None
 0.36A 4ok1A-2ax9A:
41.1		 4ok1A-2ax9A:
99.20
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.
2b3x IRON-RESPONSIVE
ELEMENT BINDING
PROTEIN 1

(Homo sapiens) 		PF00330
(Aconitase)
PF00694
(Aconitase_C) 		5 LEU A 491
LEU A 494
GLY A 495
VAL A 557
VAL A 130
 None
 0.98A 4ok1A-2b3xA:
undetectable		 4ok1A-2b3xA:
16.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2de2 DIBENZOTHIOPHENE
DESULFURIZATION
ENZYME B

(Rhodococcus sp.
IGTS8) 		no annotation 5 LEU A 281
GLY A 280
VAL A 273
ARG A 363
THR A  95
 None
 1.04A 4ok1A-2de2A:
undetectable		 4ok1A-2de2A:
20.71
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.
2f7l 455AA LONG
HYPOTHETICAL
PHOSPHO-SUGAR MUTASE

(Sulfurisphaera
tokodaii) 		PF00408
(PGM_PMM_IV)
PF02878
(PGM_PMM_I)
PF02879
(PGM_PMM_II)
PF02880
(PGM_PMM_III) 		5 LEU A  79
GLY A  91
LEU A  61
ILE A 106
VAL A  23
 None
 1.04A 4ok1A-2f7lA:
undetectable		 4ok1A-2f7lA:
20.83
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.
2gmh ELECTRON TRANSFER
FLAVOPROTEIN-UBIQUIN
ONE OXIDOREDUCTASE

(Sus scrofa) 		PF05187
(ETF_QO)
PF13450
(NAD_binding_8) 		5 LEU A  48
GLY A  47
VAL A  70
ILE A 381
VAL A 208
 None
 1.11A 4ok1A-2gmhA:
undetectable		 4ok1A-2gmhA:
16.87
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.
2nz9 BOTULINUM NEUROTOXIN
TYPE A

(Clostridium
botulinum) 		PF01742
(Peptidase_M27)
PF07951
(Toxin_R_bind_C)
PF07952
(Toxin_trans)
PF07953
(Toxin_R_bind_N) 		5 LEU A 107
LEU A 108
GLY A 104
VAL A 219
ILE A 499
 None
 1.05A 4ok1A-2nz9A:
undetectable		 4ok1A-2nz9A:
10.69
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2q3y ANCESTRAL CORTICIOD
RECEPTOR

(unidentified) 		PF00104
(Hormone_recep) 		6 LEU A  32
LEU A  35
GLN A  39
MET A  70
ARG A  80
ILE A 227
 1CA  A 247 (-4.0A)
1CA  A 247 ( 4.4A)
1CA  A 247 (-3.1A)
1CA  A 247 ( 3.8A)
1CA  A 247 (-3.8A)
None
 0.61A 4ok1A-2q3yA:
37.1		 4ok1A-2q3yA:
59.04
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.
2qkx BIFUNCTIONAL PROTEIN
GLMU

(Mycobacterium
tuberculosis) 		PF00132
(Hexapep)
PF12804
(NTP_transf_3) 		5 LEU A 100
LEU A  97
GLY A  96
LEU A  12
VAL A 109
 None
 1.00A 4ok1A-2qkxA:
undetectable		 4ok1A-2qkxA:
21.05
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.
2qs8 XAA-PRO DIPEPTIDASE

(Alteromonas
macleodii) 		PF01979
(Amidohydro_1) 		5 LEU A  62
LEU A  65
GLY A  64
VAL A 402
ILE A  37
 None
 0.98A 4ok1A-2qs8A:
undetectable		 4ok1A-2qs8A:
19.15
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.
2vz9 FATTY ACID SYNTHASE

(Sus scrofa) 		PF00107
(ADH_zinc_N)
PF00109
(ketoacyl-synt)
PF00698
(Acyl_transf_1)
PF02801
(Ketoacyl-synt_C)
PF08242
(Methyltransf_12)
PF08659
(KR)
PF14765
(PS-DH)
PF16197
(KAsynt_C_assoc) 		5 LEU A 797
LEU A 793
LEU A 563
ILE A 782
VAL A 759
 None
 1.05A 4ok1A-2vz9A:
undetectable		 4ok1A-2vz9A:
7.78
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.
2wsx L-CARNITINE/GAMMA-BU
TYROBETAINE
ANTIPORTER

(Escherichia
coli) 		PF02028
(BCCT) 		5 LEU A 403
LEU A 268
MET A 269
VAL A 273
ILE A 413
 None
 1.06A 4ok1A-2wsxA:
undetectable		 4ok1A-2wsxA:
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.
2ww9 SEC SIXTY-ONE
PROTEIN HOMOLOG

(Saccharomyces
cerevisiae) 		PF00344
(SecY)
PF10559
(Plug_translocon) 		5 LEU A 464
GLY A 460
GLN A 264
MET A 182
ILE A 183
 None
 1.13A 4ok1A-2ww9A:
undetectable		 4ok1A-2ww9A:
19.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2z2b DIHYDROOROTASE

(Escherichia
coli) 		PF01979
(Amidohydro_1) 		5 LEU A 127
LEU A 184
VAL A 235
MET A 151
ILE A 147
 KCX  A 102 ( 4.5A)
None
None
None
None
 1.10A 4ok1A-2z2bA:
undetectable		 4ok1A-2z2bA:
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.
3bga BETA-GALACTOSIDASE

(Bacteroides
thetaiotaomicron) 		PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N)
PF02929
(Bgal_small_N)
PF16353
(DUF4981) 		5 LEU A 185
LEU A  71
VAL A 209
ILE A 234
VAL A 105
 None
 1.10A 4ok1A-3bgaA:
undetectable		 4ok1A-3bgaA:
13.43
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.
3cbg O-METHYLTRANSFERASE

(Synechocystis
sp. PCC 6803) 		PF01596
(Methyltransf_3) 		5 LEU A 160
LEU A 157
GLY A 156
VAL A 167
ILE A  89
 None
 1.04A 4ok1A-3cbgA:
undetectable		 4ok1A-3cbgA:
20.77
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.
3ceb D-AMINOACID
AMINOTRANSFERASE-LIK
E PLP-DEPENDENT
ENZYME

(Histophilus
somni) 		PF01063
(Aminotran_4) 		5 LEU A 154
GLY A 156
ARG A 106
THR A 148
ILE A 168
 LLP  A 102 ( 4.2A)
LLP  A 102 ( 3.3A)
LLP  A 102 (-3.1A)
None
None
 1.16A 4ok1A-3cebA:
undetectable		 4ok1A-3cebA:
23.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ddn D-3-PHOSPHOGLYCERATE
DEHYDROGENASE

(Mycobacterium
tuberculosis) 		PF00389
(2-Hacid_dh)
PF01842
(ACT)
PF02826
(2-Hacid_dh_C) 		5 LEU A 150
GLY A 151
GLN A 155
ILE A 378
VAL A 385
 None
 0.85A 4ok1A-3ddnA:
undetectable		 4ok1A-3ddnA:
17.98
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.
3dj4 BIFUNCTIONAL PROTEIN
GLMU

(Mycobacterium
tuberculosis) 		PF00132
(Hexapep)
PF12804
(NTP_transf_3) 		5 LEU A 100
LEU A  97
GLY A  96
LEU A  12
VAL A 109
 None
None
None
UD1  A4000 (-4.1A)
None
 1.05A 4ok1A-3dj4A:
undetectable		 4ok1A-3dj4A:
17.50
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.
3dou RIBOSOMAL RNA LARGE
SUBUNIT
METHYLTRANSFERASE J

(Thermoplasma
volcanium) 		PF01728
(FtsJ) 		5 GLY A  46
MET A  71
THR A  53
ILE A  63
VAL A  77
 SAM  A   1 (-3.5A)
None
None
None
None
 1.15A 4ok1A-3douA:
undetectable		 4ok1A-3douA:
22.71
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.
3e53 FATTY-ACID-COA
LIGASE FADD28

(Mycobacterium
tuberculosis) 		PF00501
(AMP-binding) 		5 LEU A  83
LEU A  80
GLY A  81
LEU A 117
VAL A 114
 None
 1.12A 4ok1A-3e53A:
undetectable		 4ok1A-3e53A:
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.
3hn2 2-DEHYDROPANTOATE
2-REDUCTASE

(Geobacter
metallireducens) 		PF02558
(ApbA)
PF08546
(ApbA_C) 		5 LEU A 197
LEU A 194
GLY A 193
THR A 301
MET A 257
 None
 1.11A 4ok1A-3hn2A:
undetectable		 4ok1A-3hn2A:
19.77
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.
3ihm STYRENE
MONOOXYGENASE A

(Pseudomonas
putida) 		no annotation 5 LEU A 261
LEU A 240
MET A 239
ILE A 176
VAL A 250
 None
 1.14A 4ok1A-3ihmA:
undetectable		 4ok1A-3ihmA:
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.
3jux PROTEIN TRANSLOCASE
SUBUNIT SECA

(Thermotoga
maritima) 		PF00271
(Helicase_C)
PF01043
(SecA_PP_bind)
PF07516
(SecA_SW)
PF07517
(SecA_DEAD) 		5 LEU A 478
LEU A 494
VAL A 503
THR A 555
ILE A 463
 None
 1.12A 4ok1A-3juxA:
undetectable		 4ok1A-3juxA:
14.12
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.
3k8v FLAGELLIN HOMOLOG

(Sphingomonas
sp. A1) 		PF00669
(Flagellin_N)
PF00700
(Flagellin_C)
PF07196
(Flagellin_IN) 		5 LEU A 174
GLY A 281
THR A 296
ILE A  92
VAL A 116
 None
 1.15A 4ok1A-3k8vA:
undetectable		 4ok1A-3k8vA:
19.94
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3kba PROGESTERONE
RECEPTOR

(Homo sapiens) 		PF00104
(Hormone_recep) 		7 LEU A 718
LEU A 721
GLY A 722
MET A 756
VAL A 760
ARG A 766
ILE A 913
 WOW  A   1 (-4.2A)
WOW  A   1 ( 4.3A)
WOW  A   1 ( 4.3A)
WOW  A   1 ( 4.1A)
WOW  A   1 (-4.1A)
WOW  A   1 (-3.8A)
None
 0.52A 4ok1A-3kbaA:
34.8		 4ok1A-3kbaA:
54.76
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3kba PROGESTERONE
RECEPTOR

(Homo sapiens) 		PF00104
(Hormone_recep) 		7 LEU A 718
LEU A 721
GLY A 722
MET A 756
VAL A 760
ARG A 766
MET A 909
 WOW  A   1 (-4.2A)
WOW  A   1 ( 4.3A)
WOW  A   1 ( 4.3A)
WOW  A   1 ( 4.1A)
WOW  A   1 (-4.1A)
WOW  A   1 (-3.8A)
None
 1.10A 4ok1A-3kbaA:
34.8		 4ok1A-3kbaA:
54.76
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3kba PROGESTERONE
RECEPTOR

(Homo sapiens) 		PF00104
(Hormone_recep) 		7 LEU A 721
GLY A 722
GLN A 725
MET A 756
VAL A 760
ARG A 766
ILE A 913
 WOW  A   1 ( 4.3A)
WOW  A   1 ( 4.3A)
WOW  A   1 ( 4.1A)
WOW  A   1 ( 4.1A)
WOW  A   1 (-4.1A)
WOW  A   1 (-3.8A)
None
 0.68A 4ok1A-3kbaA:
34.8		 4ok1A-3kbaA:
54.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3mtw L-ARGININE
CARBOXYPEPTIDASE
CC2672

(Caulobacter
vibrioides) 		PF01979
(Amidohydro_1) 		5 LEU A  83
LEU A  86
GLY A  85
ILE A  58
VAL A  53
 None
 1.16A 4ok1A-3mtwA:
undetectable		 4ok1A-3mtwA:
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.
3omb EXTRACELLULAR
SOLUTE-BINDING
PROTEIN, FAMILY 1

(Bifidobacterium
longum) 		PF01547
(SBP_bac_1) 		6 LEU A 421
LEU A 417
GLY A 416
GLN A  51
ILE A 390
VAL A 400
 None
 1.37A 4ok1A-3ombA:
undetectable		 4ok1A-3ombA:
17.79
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.
3ops MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN

(Paenibacillus
sp. Y412MC10) 		PF13378
(MR_MLE_C) 		5 LEU A 100
LEU A 103
GLY A 104
GLN A 107
VAL A 359
 None
 1.09A 4ok1A-3opsA:
undetectable		 4ok1A-3opsA:
18.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3q1n GALACTOSE MUTAROTASE
RELATED ENZYME

(Lactobacillus
paracasei) 		PF01263
(Aldose_epim) 		5 LEU A  48
GLY A  53
GLN A  71
THR A 239
ILE A 208
 NO3  A 295 ( 3.8A)
NO3  A 296 ( 3.1A)
NO3  A 296 (-3.7A)
EDO  A 302 ( 4.9A)
None
 1.14A 4ok1A-3q1nA:
undetectable		 4ok1A-3q1nA:
21.32
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.
3qld MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN

(Alicyclobacillus
acidocaldarius) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 LEU A 126
LEU A 129
GLY A 128
ARG A  91
VAL A 137
 None
 1.14A 4ok1A-3qldA:
undetectable		 4ok1A-3qldA:
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.
3r4v PUTATIVE
UNCHARACTERIZED
PROTEIN

(Pseudomonas
phage 201phi2-1) 		PF00091
(Tubulin) 		5 LEU A 101
LEU A  98
GLY A  99
ILE A 148
VAL A 208
 None
 1.09A 4ok1A-3r4vA:
undetectable		 4ok1A-3r4vA:
22.81
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.
3r9w GTPASE ERA

(Aquifex
aeolicus) 		PF01926
(MMR_HSR1)
PF07650
(KH_2) 		6 LEU A 179
LEU A  43
VAL A   6
MET A 184
ILE A 185
VAL A  28
 None
 1.36A 4ok1A-3r9wA:
undetectable		 4ok1A-3r9wA:
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.
3rhy N(G),N(G)-DIMETHYLAR
GININE
DIMETHYLAMINOHYDROLA
SE

(Pseudomonas
aeruginosa) 		PF02274
(Amidinotransf) 		5 GLY A 246
VAL A  64
ARG A  85
ILE A 213
VAL A 208
 None
None
HM3  A 255 ( 4.7A)
None
None
 1.04A 4ok1A-3rhyA:
undetectable		 4ok1A-3rhyA:
22.57
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.
3rko NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT M

(Escherichia
coli) 		no annotation 5 LEU M 186
LEU M 183
GLY M 182
LEU M 147
VAL M 130
 None
 1.15A 4ok1A-3rkoM:
undetectable		 4ok1A-3rkoM:
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.
3rmt 3-PHOSPHOSHIKIMATE
1-CARBOXYVINYLTRANSF
ERASE 1

(Bacillus
halodurans) 		PF00275
(EPSP_synthase) 		5 LEU A 104
GLY A 105
LEU A 159
MET A 137
ILE A 220
 None
 1.09A 4ok1A-3rmtA:
undetectable		 4ok1A-3rmtA:
17.88
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ry9 ANCESTRAL
GLUCOCORTICOID
RECEPTOR 1

(synthetic
construct) 		PF00104
(Hormone_recep) 		7 LEU A  32
LEU A  35
GLY A  36
GLN A  39
MET A  70
ARG A  80
ILE A 227
 1CA  A 249 (-3.9A)
1CA  A 249 ( 4.4A)
1CA  A 249 ( 4.0A)
1CA  A 249 (-3.0A)
1CA  A 249 ( 3.8A)
1CA  A 249 (-3.5A)
None
 0.61A 4ok1A-3ry9A:
36.1		 4ok1A-3ry9A:
54.80
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.
3stg 2-DEHYDRO-3-DEOXYPHO
SPHOOCTONATE
ALDOLASE

(Neisseria
meningitidis) 		PF00793
(DAHP_synth_1) 		5 LEU A  18
LEU A 221
GLY A 220
ILE A   5
VAL A 130
 None
 1.15A 4ok1A-3stgA:
undetectable		 4ok1A-3stgA:
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.
3tqd 3-DEOXY-MANNO-OCTULO
SONATE
CYTIDYLYLTRANSFERASE

(Coxiella
burnetii) 		PF02348
(CTP_transf_3) 		5 GLY A  99
GLN A  98
VAL A 184
ILE A  24
VAL A 245
 None
 1.14A 4ok1A-3tqdA:
undetectable		 4ok1A-3tqdA:
21.72
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.
3un6 HYPOTHETICAL PROTEIN
SAOUHSC_00137

(Staphylococcus
aureus) 		PF13379
(NMT1_2) 		6 LEU A  82
LEU A  78
GLY A  40
LEU A  50
VAL A 222
ILE A  37
 None
 1.25A 4ok1A-3un6A:
undetectable		 4ok1A-3un6A:
22.89
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.
3va7 KLLA0E08119P

(Kluyveromyces
lactis) 		PF00289
(Biotin_carb_N)
PF00364
(Biotin_lipoyl)
PF02626
(CT_A_B)
PF02682
(CT_C_D)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2) 		5 GLN A 916
MET A 834
VAL A 895
MET A 934
ILE A 937
 GOL  A1904 (-4.5A)
None
None
GOL  A1905 (-4.1A)
None
 1.07A 4ok1A-3va7A:
undetectable		 4ok1A-3va7A:
11.24
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.
4ae0 DIPHTHERIA TOXIN

(Corynebacterium
diphtheriae) 		PF01324
(Diphtheria_R)
PF02763
(Diphtheria_C)
PF02764
(Diphtheria_T) 		5 LEU A 512
GLY A 431
LEU A 487
MET A 459
ILE A 457
 None
 1.13A 4ok1A-4ae0A:
undetectable		 4ok1A-4ae0A:
16.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4cgr PUTATIVE TETR-FAMILY
TRANSCRIPTIONAL
REGULATOR

(Streptomyces
coelicolor) 		PF00440
(TetR_N) 		5 LEU A  83
LEU A  86
GLY A  87
LEU A 116
ILE A 134
 None
 0.99A 4ok1A-4cgrA:
undetectable		 4ok1A-4cgrA:
20.00
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.
4ev4 CARBAPENEM-HYDROLIZI
NG BETA-LACTAMASE
SFC-1

(Serratia
fonticola) 		PF13354
(Beta-lactamase2) 		5 GLY A  74
LEU A 207
VAL A 249
ILE A 155
VAL A 198
 None
 1.06A 4ok1A-4ev4A:
undetectable		 4ok1A-4ev4A:
22.07
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.
4f5x RNA-DIRECTED RNA
POLYMERASE

(Rotavirus A) 		PF02123
(RdRP_4)
PF12289
(Rotavirus_VP1) 		5 LEU W 542
LEU W 558
VAL W 477
THR W 564
ILE W 438
 None
 1.11A 4ok1A-4f5xW:
undetectable		 4ok1A-4f5xW:
12.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4hnh NAD-DEPENDENT
EPIMERASE/DEHYDRATAS
E

(Veillonella
parvula) 		PF13460
(NAD_binding_10) 		5 GLY A   9
LEU A  37
THR A  19
ILE A  30
VAL A  51
 NAP  A 301 ( 3.9A)
None
None
None
None
 0.94A 4ok1A-4hnhA:
undetectable		 4ok1A-4hnhA:
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.
4htl BETA-GLUCOSIDE
KINASE

(Listeria
monocytogenes) 		PF00480
(ROK) 		5 LEU A 279
LEU A 280
GLY A 281
ILE A 100
VAL A  65
 None
 1.15A 4ok1A-4htlA:
undetectable		 4ok1A-4htlA:
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.
4ina SACCHAROPINE
DEHYDROGENASE

(Wolinella
succinogenes) 		PF03435
(Sacchrp_dh_NADP)
PF16653
(Sacchrp_dh_C) 		5 LEU A 137
GLY A 139
VAL A 146
ILE A  83
VAL A  12
 None
 1.09A 4ok1A-4inaA:
undetectable		 4ok1A-4inaA:
21.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4iw4 MANNAN-BINDING
LECTIN SERINE
PROTEASE 3

(Homo sapiens) 		PF00089
(Trypsin) 		5 LEU E 568
GLY E 569
VAL E 606
THR E 640
VAL E 665
 None
 1.14A 4ok1A-4iw4E:
undetectable		 4ok1A-4iw4E:
23.13
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.
4juu EPIMERASE

(Xanthomonas
campestris) 		PF05544
(Pro_racemase) 		5 LEU A  65
GLY A  75
VAL A 116
THR A  92
VAL A 121
 PO4  A 402 ( 4.7A)
None
None
None
None
 1.08A 4ok1A-4juuA:
undetectable		 4ok1A-4juuA:
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.
4m8j L-CARNITINE/GAMMA-BU
TYROBETAINE
ANTIPORTER

(Proteus
mirabilis) 		PF02028
(BCCT) 		5 LEU A 403
LEU A 268
MET A 269
VAL A 273
ILE A 413
 None
 0.98A 4ok1A-4m8jA:
undetectable		 4ok1A-4m8jA:
19.18
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4p6w GLUCOCORTICOID
RECEPTOR

(Homo sapiens) 		PF00104
(Hormone_recep) 		5 LEU A 563
LEU A 566
GLY A 567
GLN A 570
ARG A 611
 MOF  A 801 (-3.9A)
MOF  A 801 ( 4.6A)
MOF  A 801 (-3.4A)
MOF  A 801 (-2.9A)
MOF  A 801 (-4.2A)
 0.68A 4ok1A-4p6wA:
32.9		 4ok1A-4p6wA:
50.40
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4p6w GLUCOCORTICOID
RECEPTOR

(Homo sapiens) 		PF00104
(Hormone_recep) 		6 LEU A 566
GLY A 567
GLN A 570
MET A 601
ARG A 611
ILE A 757
 MOF  A 801 ( 4.6A)
MOF  A 801 (-3.4A)
MOF  A 801 (-2.9A)
MOF  A 801 (-3.7A)
MOF  A 801 (-4.2A)
None
 0.66A 4ok1A-4p6wA:
32.9		 4ok1A-4p6wA:
50.40
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.
4qmk TYPE III SECRETION
SYSTEM EFFECTOR
PROTEIN EXOU

(Pseudomonas
fluorescens) 		PF01734
(Patatin) 		5 LEU A 606
GLY A 608
LEU A 585
VAL A 590
THR A 628
 None
 1.00A 4ok1A-4qmkA:
undetectable		 4ok1A-4qmkA:
17.29
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.
4r7s TETRATRICOPEPTIDE
REPEAT PROTEIN

(Parabacteroides
merdae) 		PF13432
(TPR_16) 		5 LEU A  62
LEU A  65
GLY A  66
GLN A  69
LEU A 102
 None
 0.88A 4ok1A-4r7sA:
undetectable		 4ok1A-4r7sA:
21.72
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.
4u3w 2-AMINOMUCONATE
6-SEMIALDEHYDE
DEHYDROGENASE

(Burkholderia
cenocepacia) 		PF00171
(Aldedh) 		5 LEU A 167
LEU A 215
VAL A 202
ILE A 159
VAL A 184
 None
 1.05A 4ok1A-4u3wA:
undetectable		 4ok1A-4u3wA:
18.28
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4udb MINERALOCORTICOID
RECEPTOR

(Homo sapiens) 		PF00104
(Hormone_recep) 		6 LEU A 769
LEU A 772
GLN A 776
MET A 807
ARG A 817
ILE A 964
 CV7  A1987 (-4.1A)
CV7  A1987 ( 4.5A)
CV7  A1987 (-3.0A)
CV7  A1987 ( 3.9A)
CV7  A1987 (-3.7A)
None
 0.82A 4ok1A-4udbA:
33.2		 4ok1A-4udbA:
52.17
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.
4us4 TRANSPORTER

(Bacillus
halodurans) 		PF00209
(SNF) 		5 LEU A 316
GLY A 318
LEU A  29
VAL A  27
VAL A 292
 None
None
None
NA  A 702 (-4.7A)
None
 1.16A 4ok1A-4us4A:
undetectable		 4ok1A-4us4A:
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.
4ynn PROTEASE DO

(Legionella
pneumophila) 		PF13180
(PDZ_2)
PF13365
(Trypsin_2) 		5 LEU A 112
GLY A 106
LEU A 103
VAL A  82
ILE A  75
 None
 1.14A 4ok1A-4ynnA:
undetectable		 4ok1A-4ynnA:
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.
4zpd RNA-DIRECTED RNA
POLYMERASE

(Enterovirus B) 		PF00680
(RdRP_1) 		5 LEU A 269
LEU A 253
MET A 300
ILE A 304
VAL A  78
 None
 1.17A 4ok1A-4zpdA:
undetectable		 4ok1A-4zpdA:
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.
5b3h PROTEIN SCARECROW

(Arabidopsis
thaliana) 		PF03514
(GRAS) 		5 LEU A 412
GLY A 411
LEU A 450
ILE A 403
VAL A 431
 None
 1.01A 4ok1A-5b3hA:
undetectable		 4ok1A-5b3hA:
18.88
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.
5c54 DIHYDRODIPICOLINATE
SYNTHASE/N-ACETYLNEU
RAMINATE LYASE

(Corynebacterium
glutamicum) 		PF00701
(DHDPS) 		5 LEU A 153
LEU A 162
GLY A 164
LEU A 194
ILE A 179
 None
 1.15A 4ok1A-5c54A:
undetectable		 4ok1A-5c54A:
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.
5d4w PUTATIVE HEAT SHOCK
PROTEIN

(Chaetomium
thermophilum) 		PF00004
(AAA)
PF07724
(AAA_2)
PF10431
(ClpB_D2-small) 		5 LEU A 255
LEU A 292
LEU A 211
ILE A 240
VAL A 245
 None
 1.14A 4ok1A-5d4wA:
undetectable		 4ok1A-5d4wA:
14.91
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.
5d6n ACYL-COA SYNTHASE

(Mycolicibacterium
smegmatis) 		PF00501
(AMP-binding) 		5 LEU A  98
GLY A  96
LEU A 132
VAL A 105
THR A  74
 None
 1.16A 4ok1A-5d6nA:
undetectable		 4ok1A-5d6nA:
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.
5ei0 SERPIN A12

(Homo sapiens) 		PF00079
(Serpin) 		6 LEU A 393
LEU A 405
GLY A 406
LEU A 311
ILE A 386
VAL A 308
 None
 1.43A 4ok1A-5ei0A:
undetectable		 4ok1A-5ei0A:
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.
5ey8 ACYL-COA SYNTHASE

(Mycolicibacterium
smegmatis) 		PF00501
(AMP-binding) 		5 LEU A  98
GLY A  96
LEU A 132
VAL A 105
THR A  74
 None
 1.09A 4ok1A-5ey8A:
undetectable		 4ok1A-5ey8A:
14.83
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.
5h5w FLAGELLAR
HOOK-ASSOCIATED
PROTEIN 2

(Escherichia
coli) 		PF07195
(FliD_C)
PF07196
(Flagellin_IN) 		5 LEU A 201
GLY A 206
LEU A 108
ILE A 130
VAL A 164
 None
 1.14A 4ok1A-5h5wA:
undetectable		 4ok1A-5h5wA:
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.
5hcc COMPLEMENT C5

(Homo sapiens) 		PF01835
(A2M_N)
PF07703
(A2M_N_2) 		5 LEU B 502
LEU B 504
VAL B 645
ILE B 526
VAL B 486
 None
 1.11A 4ok1A-5hccB:
undetectable		 4ok1A-5hccB:
17.05
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.
5i8i UREA AMIDOLYASE

(Kluyveromyces
lactis) 		PF00289
(Biotin_carb_N)
PF01425
(Amidase)
PF02626
(CT_A_B)
PF02682
(CT_C_D)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2) 		5 GLN A 916
MET A 834
VAL A 895
MET A 934
ILE A 937
 None
 1.09A 4ok1A-5i8iA:
undetectable		 4ok1A-5i8iA:
8.68
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.
5jxk ASP/GLU-SPECIFIC
DIPEPTIDYL-PEPTIDASE

(Porphyromonas
endodontalis) 		PF10459
(Peptidase_S46) 		5 LEU A 232
GLY A  78
VAL A  62
ILE A 713
VAL A 258
 None
 1.01A 4ok1A-5jxkA:
undetectable		 4ok1A-5jxkA:
18.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5kja APOCAROTENOID-15,15'
-OXYGENASE

(Synechocystis
sp. PCC 6803) 		PF03055
(RPE65) 		5 LEU A 460
LEU A 443
LEU A  50
ILE A  42
VAL A  86
 None
 1.14A 4ok1A-5kjaA:
undetectable		 4ok1A-5kjaA:
18.99
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.
5kqi CATALASE-PEROXIDASE

(Burkholderia
pseudomallei) 		PF00141
(peroxidase) 		5 LEU A 638
GLY A 637
LEU A 660
VAL A 477
THR A 654
 None
 1.07A 4ok1A-5kqiA:
undetectable		 4ok1A-5kqiA:
14.29
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.
5mwp MINERALOCORTICOID
RECEPTOR

(Homo sapiens) 		no annotation 6 LEU A 769
LEU A 772
GLN A 776
MET A 807
ARG A 817
ILE A 964
 ECV  A1101 (-4.7A)
ECV  A1101 ( 3.9A)
ECV  A1101 (-2.9A)
ECV  A1101 (-3.6A)
ECV  A1101 (-4.0A)
None
 0.75A 4ok1A-5mwpA:
36.3		 4ok1A-5mwpA:
21.15
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.
5ng7 EPOXIDE HYDROLASE

(metagenome) 		no annotation 5 LEU A  30
LEU A  31
GLY A  99
VAL A  96
ILE A 236
 None
 1.16A 4ok1A-5ng7A:
undetectable		 4ok1A-5ng7A:
12.80
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.
5ngy DSR-M GLUCANSUCRASE
INACTIVE MUTANT
E715Q

(Leuconostoc
citreum) 		no annotation 5 LEU A 893
LEU A 973
THR A 858
ILE A 939
VAL A 941
 None
 1.12A 4ok1A-5ngyA:
undetectable		 4ok1A-5ngyA:
10.79
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.
5nks DIHYDROPYRIMIDINASE-
RELATED PROTEIN 4

(Homo sapiens) 		no annotation 5 LEU A  66
GLY A  68
VAL A 445
ILE A  42
VAL A  37
 LEU  A  66 ( 0.6A)
GLY  A  68 ( 0.0A)
VAL  A 445 ( 0.6A)
ILE  A  42 ( 0.6A)
VAL  A  37 ( 0.6A)
 0.97A 4ok1A-5nksA:
undetectable		 4ok1A-5nksA:
17.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ovu BETA-PROTEOBACTERIA
PROTEASOME HOMOLOGUE

(Cupriavidus
metallidurans) 		no annotation 5 LEU A  47
GLY A  46
ARG A  58
ILE A 118
VAL A  12
 None
 1.15A 4ok1A-5ovuA:
undetectable		 4ok1A-5ovuA:
15.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5tf0 GLYCOSYL HYDROLASE
FAMILY 3 N-TERMINAL
DOMAIN PROTEIN

(Bacteroides
intestinalis) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C)
PF14310
(Fn3-like) 		5 LEU A 499
GLY A 468
LEU A 516
ILE A 512
VAL A 552
 None
 1.13A 4ok1A-5tf0A:
undetectable		 4ok1A-5tf0A:
14.76
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5uc1 GLUCOCORTICOID
RECEPTOR

(Heterocephalus
glaber) 		no annotation 5 LEU A 559
GLY A 563
GLN A 566
MET A 597
ARG A 607
 486  A 801 (-4.7A)
486  A 801 (-3.7A)
486  A 801 (-2.8A)
CPS  A 803 ( 3.9A)
486  A 801 (-3.5A)
 0.83A 4ok1A-5uc1A:
23.2		 4ok1A-5uc1A:
30.37
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5uc1 GLUCOCORTICOID
RECEPTOR

(Heterocephalus
glaber) 		no annotation 5 LEU A 559
LEU A 562
GLY A 563
GLN A 566
ARG A 607
 486  A 801 (-4.7A)
486  A 801 ( 4.8A)
486  A 801 (-3.7A)
486  A 801 (-2.8A)
486  A 801 (-3.5A)
 0.46A 4ok1A-5uc1A:
23.2		 4ok1A-5uc1A:
30.37
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5ufs ANCESTRAL
GLUCOCORTICOID
RECEPTOR2

(unidentified) 		PF00104
(Hormone_recep) 		5 GLY A  37
GLN A  39
MET A  70
ARG A  80
ILE A 226
 None
1TA  A 301 (-3.0A)
1TA  A 301 ( 3.1A)
1TA  A 301 (-3.5A)
None
 1.04A 4ok1A-5ufsA:
35.0		 4ok1A-5ufsA:
54.58
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5ufs ANCESTRAL
GLUCOCORTICOID
RECEPTOR2

(unidentified) 		PF00104
(Hormone_recep) 		7 LEU A  32
LEU A  35
GLY A  36
GLN A  39
MET A  70
ARG A  80
ILE A 226
 1TA  A 301 (-3.5A)
1TA  A 301 ( 3.6A)
1TA  A 301 (-2.9A)
1TA  A 301 (-3.0A)
1TA  A 301 ( 3.1A)
1TA  A 301 (-3.5A)
None
 0.76A 4ok1A-5ufsA:
35.0		 4ok1A-5ufsA:
54.58
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.
5wi5 UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE 1

(Streptococcus
pneumoniae) 		PF00275
(EPSP_synthase) 		5 LEU A 102
GLY A 103
LEU A 155
MET A 137
ILE A 219
 None
 1.07A 4ok1A-5wi5A:
undetectable		 4ok1A-5wi5A:
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.
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron) 		no annotation 5 LEU A 496
GLY A 466
LEU A 514
ILE A 510
VAL A 550
 None
 1.13A 4ok1A-5xxoA:
undetectable		 4ok1A-5xxoA:
13.60
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.
6c3b UNCHARACTERIZED
PROTEIN

(Streptomyces
cattleya) 		no annotation 5 LEU A 195
LEU A 160
LEU A 105
ILE A 253
VAL A 257
 None
None
None
None
EDO  A 402 (-3.7A)
 1.11A 4ok1A-6c3bA:
undetectable		 4ok1A-6c3bA:
16.25
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.
6cnh SERINE/THREONINE-PRO
TEIN KINASE PRP4
HOMOLOG

(Homo sapiens) 		no annotation 5 LEU A 733
LEU A 730
GLY A 729
GLN A 726
VAL A 701
 None
None
None
None
919  A1101 (-4.7A)
 0.81A 4ok1A-6cnhA:
undetectable		 4ok1A-6cnhA:
12.97
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.
6eu9 RETINOIC ACID
RECEPTOR

(Platynereis
dumerilii) 		no annotation 5 LEU A 484
VAL A 476
MET A 317
ILE A 321
VAL A 374
 None
 1.02A 4ok1A-6eu9A:
21.2		 4ok1A-6eu9A:
15.88
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.
1h1y D-RIBULOSE-5-PHOSPHA
TE 3-EPIMERASE

(Oryza sativa) 		PF00834
(Ribul_P_3_epim) 		4 ASN A 100
MET A 113
LEU A  70
ILE A  94
 None
 1.05A 4ok1A-1h1yA:
undetectable		 4ok1A-1h1yA:
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.
1ipf TROPINONE
REDUCTASE-II

(Datura
stramonium) 		PF13561
(adh_short_C2) 		4 LEU A  91
ASN A  93
LEU A  76
ILE A 117
 None
None
None
NDP  A 261 ( 4.1A)
 1.00A 4ok1A-1ipfA:
undetectable		 4ok1A-1ipfA:
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.
1jhd SULFATE
ADENYLYLTRANSFERASE

(Sulfur-oxidizing
endosymbiont of
Riftia
pachyptila) 		PF01747
(ATP-sulfurylase)
PF14306
(PUA_2) 		4 LEU A  55
MET A 131
LEU A  84
ILE A 117
 None
 0.90A 4ok1A-1jhdA:
undetectable		 4ok1A-1jhdA:
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.
1k1b B-CELL LYMPHOMA
3-ENCODED PROTEIN

(Homo sapiens) 		PF00023
(Ank)
PF12796
(Ank_2) 		4 LEU A 286
LEU A 238
HIS A 239
ILE A 273
 None
 0.89A 4ok1A-1k1bA:
undetectable		 4ok1A-1k1bA:
23.36
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.
1m72 CASPASE-1

(Spodoptera
frugiperda) 		PF00656
(Peptidase_C14) 		4 LEU A 240
MET A  55
LEU A 291
ILE A 212
 None
 0.98A 4ok1A-1m72A:
undetectable		 4ok1A-1m72A:
19.72
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.
1m9q ENDOTHELIAL
NITRIC-OXIDE
SYNTHASE

(Homo sapiens) 		PF02898
(NO_synthase) 		4 LEU A 292
ASN A 245
LEU A 304
ILE A 215
 None
 1.07A 4ok1A-1m9qA:
undetectable		 4ok1A-1m9qA:
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.
1ukv GTP-BINDING PROTEIN
YPT1

(Saccharomyces
cerevisiae) 		PF00071
(Ras) 		4 ASN Y  16
MET Y 145
LEU Y 103
ILE Y  73
 None
 0.92A 4ok1A-1ukvY:
undetectable		 4ok1A-1ukvY:
19.84
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.
1uzg MAJOR ENVELOPE
PROTEIN E

(Dengue virus) 		PF00869
(Flavi_glycoprot)
PF02832
(Flavi_glycop_C) 		4 LEU A  25
MET A 287
LEU A  41
HIS A 144
 None
 0.97A 4ok1A-1uzgA:
undetectable		 4ok1A-1uzgA:
18.27
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.
1vrn PHOTOSYNTHETIC
REACTION CENTER
CYTOCHROME C SUBUNIT

(Blastochloris
viridis) 		PF02276
(CytoC_RC) 		4 LEU C 282
ASN C 278
HIS C 124
ILE C 271
 HEM  C 402 ( 4.5A)
None
HEM  C 404 (-3.2A)
HEM  C 403 (-4.5A)
 1.05A 4ok1A-1vrnC:
undetectable		 4ok1A-1vrnC:
21.65
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.
1wst MULTIPLE SUBSTRATE
AMINOTRANSFERASE

(Thermococcus
profundus) 		PF00155
(Aminotran_1_2) 		4 LEU A 326
MET A 412
MET A 358
LEU A 349
 None
 0.99A 4ok1A-1wstA:
undetectable		 4ok1A-1wstA:
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.
1x1q TRYPTOPHAN SYNTHASE
BETA CHAIN

(Thermus
thermophilus) 		PF00291
(PALP) 		4 LEU A  70
ASN A 111
LEU A  18
ILE A 260
 None
None
None
CL  A1001 (-4.0A)
 1.06A 4ok1A-1x1qA:
undetectable		 4ok1A-1x1qA:
21.28
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.
1xhn CELLULAR REPRESSOR
OF E1A-STIMULATED
GENES

(Homo sapiens) 		PF13883
(Pyrid_oxidase_2) 		4 MET A  91
LEU A  55
HIS A 139
ILE A 137
 None
 0.97A 4ok1A-1xhnA:
undetectable		 4ok1A-1xhnA:
19.69
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2ax9 ANDROGEN RECEPTOR

(Homo sapiens) 		PF00104
(Hormone_recep) 		8 LEU A 701
ASN A 705
MET A 745
MET A 749
MET A 787
LEU A 873
HIS A 874
ILE A 898
 None
BHM  A   1 (-3.6A)
BHM  A   1 (-3.9A)
BHM  A   1 (-4.3A)
BHM  A   1 (-3.6A)
BHM  A   1 (-4.4A)
None
None
 0.37A 4ok1A-2ax9A:
41.1		 4ok1A-2ax9A:
99.20
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.
2bku IMPORTIN BETA-1
SUBUNIT

(Saccharomyces
cerevisiae) 		PF03810
(IBN_N)
PF13513
(HEAT_EZ) 		4 MET B 162
MET B 139
LEU B 104
ILE B  59
 None
 0.97A 4ok1A-2bkuB:
undetectable		 4ok1A-2bkuB:
14.72
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.
2dep THERMOSTABLE
CELLOXYLANASE

([Clostridium]
stercorarium) 		PF00331
(Glyco_hydro_10) 		4 LEU A 287
ASN A 289
LEU A 242
ILE A 275
 None
 0.88A 4ok1A-2depA:
undetectable		 4ok1A-2depA:
21.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ess ACYL-ACP
THIOESTERASE

(Bacteroides
thetaiotaomicron) 		PF01643
(Acyl-ACP_TE) 		4 LEU A  52
LEU A 129
HIS A 130
ILE A 138
 None
 1.03A 4ok1A-2essA:
undetectable		 4ok1A-2essA:
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.
2eyq TRANSCRIPTION-REPAIR
COUPLING FACTOR

(Escherichia
coli) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF02559
(CarD_CdnL_TRCF)
PF03461
(TRCF) 		4 LEU A 754
MET A 616
LEU A 725
ILE A 680
 None
 0.98A 4ok1A-2eyqA:
undetectable		 4ok1A-2eyqA:
12.17
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.
2gzs IROE PROTEIN

(Escherichia
coli) 		PF00756
(Esterase) 		4 MET A 242
LEU A 239
HIS A 238
ILE A 302
 None
 1.06A 4ok1A-2gzsA:
undetectable		 4ok1A-2gzsA:
21.40
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.
2hng HYPOTHETICAL PROTEIN

(Streptococcus
pneumoniae) 		PF06619
(DUF1149) 		4 LEU A   7
ASN A  78
LEU A  91
ILE A  58
 None
 1.02A 4ok1A-2hngA:
undetectable		 4ok1A-2hngA:
19.84
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.
2j5b TYROSYL-TRNA
SYNTHETASE

(Acanthamoeba
polyphaga
mimivirus) 		PF00579
(tRNA-synt_1b) 		4 LEU A 182
ASN A 190
MET A 127
ILE A 204
 LEU  A 182 (-0.6A)
ASN  A 190 ( 0.6A)
MET  A 127 ( 0.0A)
ILE  A 204 ( 0.7A)
 0.87A 4ok1A-2j5bA:
undetectable		 4ok1A-2j5bA:
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.
2jx3 PROTEIN DEK

(Homo sapiens) 		PF02037
(SAP) 		4 LEU A 106
LEU A  32
HIS A  33
ILE A   3
 None
 1.03A 4ok1A-2jx3A:
undetectable		 4ok1A-2jx3A:
18.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2nn3 CASPASE-1

(Spodoptera
frugiperda) 		PF00656
(Peptidase_C14) 		4 LEU C 240
MET C  55
LEU C 291
ILE C 212
 None
 0.94A 4ok1A-2nn3C:
undetectable		 4ok1A-2nn3C:
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.
2oda HYPOTHETICAL PROTEIN
PSPTO_2114

(Pseudomonas
syringae group
genomosp. 3) 		no annotation 4 LEU A 117
MET A  77
LEU A  17
ILE A 173
 None
 1.00A 4ok1A-2odaA:
undetectable		 4ok1A-2odaA:
22.75
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.
2po4 VIRION RNA
POLYMERASE

(Escherichia
virus N4) 		no annotation 4 ASN A 617
MET A 569
LEU A 611
ILE A 654
 None
 1.01A 4ok1A-2po4A:
undetectable		 4ok1A-2po4A:
13.31
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2q3y ANCESTRAL CORTICIOD
RECEPTOR

(unidentified) 		PF00104
(Hormone_recep) 		5 ASN A  33
MET A  73
MET A 115
LEU A 201
ILE A 226
 1CA  A 247 (-2.9A)
1CA  A 247 (-3.6A)
1CA  A 247 ( 3.7A)
1CA  A 247 ( 4.2A)
None
 0.87A 4ok1A-2q3yA:
37.1		 4ok1A-2q3yA:
59.04
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2q3y ANCESTRAL CORTICIOD
RECEPTOR

(unidentified) 		PF00104
(Hormone_recep) 		5 LEU A  29
ASN A  33
MET A  73
MET A 115
LEU A 201
 1CA  A 247 ( 3.6A)
1CA  A 247 (-2.9A)
1CA  A 247 (-3.6A)
1CA  A 247 ( 3.7A)
1CA  A 247 ( 4.2A)
 0.86A 4ok1A-2q3yA:
37.1		 4ok1A-2q3yA:
59.04
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.
3au9 1-DEOXY-D-XYLULOSE
5-PHOSPHATE
REDUCTOISOMERASE

(Plasmodium
falciparum) 		PF02670
(DXP_reductoisom)
PF08436
(DXP_redisom_C)
PF13288
(DXPR_C) 		4 LEU A 252
MET A 464
LEU A 187
ILE A 177
 None
 1.05A 4ok1A-3au9A:
undetectable		 4ok1A-3au9A:
19.07
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.
3b2d CD180 ANTIGEN

(Homo sapiens) 		PF00560
(LRR_1)
PF13855
(LRR_8) 		4 LEU A  84
ASN A 111
HIS A  93
ILE A 114
 None
 1.02A 4ok1A-3b2dA:
undetectable		 4ok1A-3b2dA:
20.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3b95 EUCHROMATIC
HISTONE-LYSINE
N-METHYLTRANSFERASE
1

(Homo sapiens) 		PF12796
(Ank_2)
PF13637
(Ank_4) 		4 LEU A 860
LEU A 812
HIS A 813
ILE A 847
 None
 0.98A 4ok1A-3b95A:
undetectable		 4ok1A-3b95A:
24.01
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.
3d36 SPORULATION KINASE B

(Geobacillus
stearothermophilus) 		PF00512
(HisKA)
PF02518
(HATPase_c) 		4 ASN A 320
MET A 357
LEU A 365
ILE A 389
 None
ADP  A 500 (-3.6A)
ADP  A 500 (-4.3A)
None
 1.03A 4ok1A-3d36A:
undetectable		 4ok1A-3d36A:
22.59
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.
3dxo UNCHARACTERIZED
SNOAL-LIKE PROTEIN

(Agrobacterium
fabrum) 		PF12680
(SnoaL_2) 		4 LEU A  12
ASN A  16
MET A  53
MET A  42
 None
None
None
PGE  A 121 ( 4.3A)
 1.03A 4ok1A-3dxoA:
undetectable		 4ok1A-3dxoA:
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.
3dzu PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA

(Homo sapiens) 		PF00104
(Hormone_recep)
PF00105
(zf-C4) 		4 MET D 463
LEU D 453
HIS D 449
ILE D 326
 None
None
None
PLB  D 701 ( 4.5A)
 0.97A 4ok1A-3dzuD:
18.1		 4ok1A-3dzuD:
19.24
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.
3ew7 LMO0794 PROTEIN

(Listeria
monocytogenes) 		PF13460
(NAD_binding_10) 		4 LEU A 204
ASN A 205
LEU A  99
ILE A  87
 None
 0.96A 4ok1A-3ew7A:
undetectable		 4ok1A-3ew7A:
21.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3g5i PYRIMIDINE-SPECIFIC
RIBONUCLEOSIDE
HYDROLASE RIHA

(Escherichia
coli) 		PF01156
(IU_nuc_hydro) 		4 LEU A   6
LEU A 140
HIS A 141
ILE A 176
 None
 1.06A 4ok1A-3g5iA:
undetectable		 4ok1A-3g5iA:
21.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gmg UNCHARACTERIZED
PROTEIN
RV1825/MT1873

(Mycobacterium
tuberculosis) 		PF05949
(DUF881) 		4 ASN A 202
MET A 184
MET A 249
LEU A 191
 None
 1.02A 4ok1A-3gmgA:
undetectable		 4ok1A-3gmgA:
20.87
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.
3ihy PHOSPHATIDYLINOSITOL
3-KINASE CATALYTIC
SUBUNIT TYPE 3

(Homo sapiens) 		PF00454
(PI3_PI4_kinase)
PF00613
(PI3Ka) 		4 LEU A 665
MET A 777
MET A 859
ILE A 650
 None
 0.99A 4ok1A-3ihyA:
undetectable		 4ok1A-3ihyA:
17.56
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.
3jbl NLR FAMILY CARD
DOMAIN-CONTAINING
PROTEIN 4

(Mus musculus) 		no annotation 4 LEU K 847
ASN K 843
MET K 808
LEU K 787
 None
 0.97A 4ok1A-3jblK:
undetectable		 4ok1A-3jblK:
15.69
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3kba PROGESTERONE
RECEPTOR

(Homo sapiens) 		PF00104
(Hormone_recep) 		5 ASN A 719
MET A 759
MET A 801
LEU A 887
HIS A 888
 WOW  A   1 (-3.3A)
WOW  A   1 (-3.7A)
WOW  A   1 (-4.2A)
WOW  A   1 (-4.0A)
None
 1.09A 4ok1A-3kbaA:
34.8		 4ok1A-3kbaA:
54.76
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3kba PROGESTERONE
RECEPTOR

(Homo sapiens) 		PF00104
(Hormone_recep) 		5 LEU A 715
ASN A 719
MET A 759
MET A 801
HIS A 888
 WOW  A   1 (-3.9A)
WOW  A   1 (-3.3A)
WOW  A   1 (-3.7A)
WOW  A   1 (-4.2A)
None
 0.95A 4ok1A-3kbaA:
34.8		 4ok1A-3kbaA:
54.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3l3s ENOYL-COA
HYDRATASE/ISOMERASE
FAMILY PROTEIN

(Ruegeria
pomeroyi) 		PF00378
(ECH_1) 		4 LEU A  10
MET A  98
LEU A 123
ILE A  63
 None
 1.07A 4ok1A-3l3sA:
undetectable		 4ok1A-3l3sA:
18.49
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.
3o6x GLUTAMINE SYNTHETASE

(Bacteroides
fragilis) 		PF00120
(Gln-synt_C)
PF12437
(GSIII_N) 		4 LEU A 303
ASN A 302
MET A  41
ILE A 168
 None
 0.92A 4ok1A-3o6xA:
undetectable		 4ok1A-3o6xA:
16.23
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.
3olq UNIVERSAL STRESS
PROTEIN E

(Proteus
mirabilis) 		PF00582
(Usp) 		4 LEU A 298
LEU A   7
HIS A 109
ILE A 100
 None
 1.07A 4ok1A-3olqA:
undetectable		 4ok1A-3olqA:
21.10
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.
3p9u TETX2 PROTEIN

(Bacteroides
thetaiotaomicron) 		PF01494
(FAD_binding_3) 		4 ASN A 168
LEU A 315
HIS A 314
ILE A 309
 FAD  A 401 (-4.7A)
None
None
None
 0.96A 4ok1A-3p9uA:
undetectable		 4ok1A-3p9uA:
20.58
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.
3q5e ATLASTIN-1

(Homo sapiens) 		PF02263
(GBP) 		4 ASN A 177
MET A  87
LEU A 297
ILE A 213
 None
 1.03A 4ok1A-3q5eA:
undetectable		 4ok1A-3q5eA:
20.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3rg1 CD180 MOLECULE

(Bos taurus) 		PF00560
(LRR_1)
PF13855
(LRR_8) 		4 LEU A  84
ASN A 111
HIS A  93
ILE A 114
 None
 0.97A 4ok1A-3rg1A:
undetectable		 4ok1A-3rg1A:
16.96
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ry9 ANCESTRAL
GLUCOCORTICOID
RECEPTOR 1

(synthetic
construct) 		PF00104
(Hormone_recep) 		4 ASN A  33
MET A  73
LEU A 201
ILE A 226
 1CA  A 249 (-3.0A)
1CA  A 249 (-3.9A)
1CA  A 249 ( 4.2A)
None
 0.84A 4ok1A-3ry9A:
36.1		 4ok1A-3ry9A:
54.80
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.
3sip CASPASE

(Drosophila
melanogaster) 		PF00656
(Peptidase_C14) 		4 LEU B 202
MET A  15
LEU B 253
ILE B 174
 None
 0.96A 4ok1A-3sipB:
undetectable		 4ok1A-3sipB:
18.03
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.
3sir CASPASE

(Drosophila
melanogaster) 		PF00656
(Peptidase_C14) 		4 LEU A 202
MET A  15
LEU A 253
ILE A 174
 None
 0.96A 4ok1A-3sirA:
undetectable		 4ok1A-3sirA:
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.
3t6q CD180 ANTIGEN

(Mus musculus) 		PF13855
(LRR_8) 		4 LEU A  84
ASN A 111
HIS A  93
ILE A 114
 None
 0.86A 4ok1A-3t6qA:
undetectable		 4ok1A-3t6qA:
16.09
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.
3uc9 INCREASED
RECOMBINATION
CENTERS PROTEIN 6

(Saccharomyces
cerevisiae) 		no annotation 4 LEU A 166
LEU A  21
HIS A  18
ILE A  92
 None
 1.02A 4ok1A-3uc9A:
undetectable		 4ok1A-3uc9A:
18.94
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.
4bev COPPER EFFLUX ATPASE

(Legionella
pneumophila) 		PF00122
(E1-E2_ATPase)
PF00702
(Hydrolase) 		4 MET A 537
MET A 539
LEU A 438
ILE A 281
 None
 0.84A 4ok1A-4bevA:
undetectable		 4ok1A-4bevA:
15.71
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.
4cuk D-LACTATE
DEHYDROGENASE

(Salmonella
enterica) 		PF00389
(2-Hacid_dh)
PF02826
(2-Hacid_dh_C) 		4 LEU A 255
LEU A 203
HIS A 204
ILE A 110
 None
 0.93A 4ok1A-4cukA:
undetectable		 4ok1A-4cukA:
22.61
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.
4dxy CYTOCHROME P450

(Novosphingobium
aromaticivorans) 		PF00067
(p450) 		4 LEU A 381
LEU A 276
HIS A 273
ILE A 268
 None
None
PEG  A 506 (-3.7A)
None
 1.05A 4ok1A-4dxyA:
2.4		 4ok1A-4dxyA:
20.67
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.
4exj UNCHARACTERIZED
PROTEIN

(Lodderomyces
elongisporus) 		PF00043
(GST_C)
PF13417
(GST_N_3) 		4 ASN A 205
MET A  30
LEU A  16
ILE A 201
 None
 0.96A 4ok1A-4exjA:
undetectable		 4ok1A-4exjA:
23.16
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.
4hu3 OXYGEN SENSOR
PROTEIN DOSP

(Escherichia
coli) 		PF00563
(EAL) 		4 LEU A 636
MET A 690
MET A 654
LEU A 664
 None
 0.94A 4ok1A-4hu3A:
undetectable		 4ok1A-4hu3A:
23.05
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.
4hxq ARGINASE-1

(Homo sapiens) 		PF00491
(Arginase) 		4 LEU A 216
LEU A 229
HIS A 228
ILE A 169
 None
 0.81A 4ok1A-4hxqA:
undetectable		 4ok1A-4hxqA:
22.73
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.
4l6u PUTATIVE
UNCHARACTERIZED
PROTEIN

(Archaeoglobus
fulgidus) 		PF03787
(RAMPs) 		4 LEU A 167
MET A  37
LEU A  10
ILE A 283
 None
 0.91A 4ok1A-4l6uA:
undetectable		 4ok1A-4l6uA:
24.34
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.
4n8y PUTATIVE TRAP-TYPE
C4-DICARBOXYLATE
TRANSPORT SYSTEM,
BINDING PERIPLASMIC
PROTEIN (DCTP
SUBUNIT)

(Bradyrhizobium
sp. BTAi1) 		PF03480
(DctP) 		4 LEU A  76
MET A  44
LEU A 235
ILE A 125
 None
 1.01A 4ok1A-4n8yA:
undetectable		 4ok1A-4n8yA:
22.57
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.
4ng4 PHOSPHOGLYCERATE
KINASE

(Coxiella
burnetii) 		PF00162
(PGK) 		4 LEU A  94
MET A  29
LEU A  63
HIS A  62
 None
 0.97A 4ok1A-4ng4A:
undetectable		 4ok1A-4ng4A:
22.50
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.
4o1o RIBONUCLEASE L

(Sus scrofa) 		PF00069
(Pkinase)
PF06479
(Ribonuc_2-5A)
PF12796
(Ank_2)
PF13857
(Ank_5) 		4 LEU A 108
LEU A  61
HIS A  62
ILE A  95
 None
 1.03A 4ok1A-4o1oA:
undetectable		 4ok1A-4o1oA:
17.26
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.
4om7 TOLL-LIKE RECEPTOR 6

(Homo sapiens) 		PF01582
(TIR) 		4 ASN A 690
LEU A 673
HIS A 674
ILE A 684
 None
 1.06A 4ok1A-4om7A:
undetectable		 4ok1A-4om7A:
19.62
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.
4ou4 ALPHA/BETA HYDROLASE
FOLD-3 DOMAIN
PROTEIN

(Pseudomonas sp.
ECU1011) 		PF07859
(Abhydrolase_3) 		4 LEU A 290
ASN A 158
MET A 212
LEU A  91
 None
 1.01A 4ok1A-4ou4A:
undetectable		 4ok1A-4ou4A:
22.92
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.
4pue ENDO-1,4-BETA-XYLANA
SE

(Geobacillus
stearothermophilus) 		PF00331
(Glyco_hydro_10) 		4 LEU A 259
ASN A 261
LEU A 214
ILE A 247
 None
 0.87A 4ok1A-4pueA:
undetectable		 4ok1A-4pueA:
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.
4qxe LEUCINE-RICH
REPEAT-CONTAINING
G-PROTEIN COUPLED
RECEPTOR 4, LINKER,
VARIABLE LYMPHOCYTE
RECEPTOR B

(Eptatretus
burgeri;
Homo sapiens) 		PF01462
(LRRNT)
PF11921
(DUF3439)
PF13516
(LRR_6)
PF13855
(LRR_8) 		4 LEU A 247
ASN A 271
LEU A 232
ILE A 263
 None
 1.02A 4ok1A-4qxeA:
undetectable		 4ok1A-4qxeA:
21.78
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.
4rc6 ALDEHYDE
DECARBONYLASE

(Synechococcus
elongatus) 		PF11266
(Ald_deCOase) 		4 LEU B 108
MET B 180
LEU B  90
HIS B  91
 None
 1.05A 4ok1A-4rc6B:
undetectable		 4ok1A-4rc6B:
24.91
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4udb MINERALOCORTICOID
RECEPTOR

(Homo sapiens) 		PF00104
(Hormone_recep) 		4 LEU A 766
ASN A 770
LEU A 938
ILE A 963
 CV7  A1987 (-3.6A)
CV7  A1987 (-3.1A)
CV7  A1987 ( 3.9A)
None
 0.64A 4ok1A-4udbA:
33.2		 4ok1A-4udbA:
52.17
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4udb MINERALOCORTICOID
RECEPTOR

(Homo sapiens) 		PF00104
(Hormone_recep) 		4 LEU A 766
MET A 852
LEU A 938
ILE A 963
 CV7  A1987 (-3.6A)
CV7  A1987 ( 3.7A)
CV7  A1987 ( 3.9A)
None
 0.89A 4ok1A-4udbA:
33.2		 4ok1A-4udbA:
52.17
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.
4yu9 GLUTAMINYL-PEPTIDE
CYCLOTRANSFERASE

(Homo sapiens) 		PF04389
(Peptidase_M28) 		4 LEU A 271
MET A 166
LEU A 247
ILE A 303
 None
 1.03A 4ok1A-4yu9A:
undetectable		 4ok1A-4yu9A:
23.15
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.
4zrs ESTERASE

(uncultured
bacterium) 		PF07859
(Abhydrolase_3) 		4 MET A 255
MET A 223
MET A 280
LEU A 258
 None
 0.99A 4ok1A-4zrsA:
undetectable		 4ok1A-4zrsA:
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.
5ck7 ADP-DEPENDENT
GLUCOKINASE

(Mus musculus) 		PF04587
(ADP_PFK_GK) 		4 LEU A 243
MET A 301
LEU A 296
HIS A 295
 None
 0.87A 4ok1A-5ck7A:
undetectable		 4ok1A-5ck7A:
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.
5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE

(Bacillus
megaterium) 		PF00067
(p450) 		4 LEU A 133
MET A 145
LEU A 126
ILE A 453
 None
 1.02A 4ok1A-5e78A:
undetectable		 4ok1A-5e78A:
17.25
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.
5f1p PTMO8

(Streptomyces
platensis) 		PF13561
(adh_short_C2) 		4 LEU A 171
ASN A 145
LEU A 132
ILE A  87
 None
 1.03A 4ok1A-5f1pA:
undetectable		 4ok1A-5f1pA:
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.
5f9s SERINE--PYRUVATE
AMINOTRANSFERASE

(Homo sapiens) 		PF00266
(Aminotran_5) 		4 ASN A  72
MET A 230
LEU A 179
ILE A 220
 None
 0.96A 4ok1A-5f9sA:
undetectable		 4ok1A-5f9sA:
21.79
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.
5fm2 PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE RECEPTOR RET

(Homo sapiens) 		PF07714
(Pkinase_Tyr) 		4 LEU A 816
MET A 984
MET A 980
ILE A 890
 None
 0.82A 4ok1A-5fm2A:
undetectable		 4ok1A-5fm2A:
21.27
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.
5ftf TPR DOMAIN PROTEIN

(Bacteroides sp.
3_1_23) 		PF05970
(PIF1) 		4 LEU A 122
LEU A  67
HIS A  68
ILE A  78
 None
 0.93A 4ok1A-5ftfA:
undetectable		 4ok1A-5ftfA:
20.23
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.
5gjv VOLTAGE-DEPENDENT
L-TYPE CALCIUM
CHANNEL SUBUNIT
ALPHA-1S

(Oryctolagus
cuniculus) 		PF00520
(Ion_trans)
PF08763
(Ca_chan_IQ)
PF16905
(GPHH) 		4 LEU A 472
ASN A 468
LEU A 512
ILE A 524
 None
 1.02A 4ok1A-5gjvA:
1.5		 4ok1A-5gjvA:
8.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5hly INHIBIN BETA A CHAIN

(Homo sapiens) 		PF00019
(TGF_beta)
PF00688
(TGFb_propeptide) 		4 MET A 399
MET A 401
LEU A  66
HIS A  67
 None
 0.97A 4ok1A-5hlyA:
undetectable		 4ok1A-5hlyA:
21.66
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.
5jm0 ALPHA-MANNOSIDASE,AL
PHA-MANNOSIDASE,ALPH
A-MANNOSIDASE

(Saccharomyces
cerevisiae) 		PF01074
(Glyco_hydro_38)
PF07748
(Glyco_hydro_38C)
PF09261
(Alpha-mann_mid) 		4 LEU A 497
ASN A 296
HIS A 626
ILE A 299
 None
 1.00A 4ok1A-5jm0A:
undetectable		 4ok1A-5jm0A:
12.24
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.
5m22 HYDROQUINONE
DIOXYGENASE LARGE
SUBUNIT
HYDROQUINONE
DIOXYGENASE SMALL
SUBUNIT

(Sphingomonas
sp. TTNP3) 		no annotation 4 LEU A 148
MET B 174
LEU B 221
ILE A 121
 None
 0.89A 4ok1A-5m22A:
undetectable		 4ok1A-5m22A:
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.
5m5p PRE-MRNA-SPLICING
HELICASE BRR2

(Saccharomyces
cerevisiae) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF02889
(Sec63) 		4 LEU A1511
LEU A1384
HIS A1387
ILE A1506
 None
 0.88A 4ok1A-5m5pA:
undetectable		 4ok1A-5m5pA:
8.67
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.
5mrw POTASSIUM-TRANSPORTI
NG ATPASE
POTASSIUM-BINDING
SUBUNIT

(Escherichia
coli) 		PF03814
(KdpA) 		4 LEU A 380
MET A  17
LEU A 284
ILE A 532
 None
 1.01A 4ok1A-5mrwA:
undetectable		 4ok1A-5mrwA:
17.69
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.
5mwp MINERALOCORTICOID
RECEPTOR

(Homo sapiens) 		no annotation 4 ASN A 770
MET A 852
LEU A 938
ILE A 963
 ECV  A1101 (-3.1A)
ECV  A1101 (-3.7A)
ECV  A1101 ( 4.3A)
None
 0.77A 4ok1A-5mwpA:
36.3		 4ok1A-5mwpA:
21.15
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.
5mwp MINERALOCORTICOID
RECEPTOR

(Homo sapiens) 		no annotation 4 LEU A 766
ASN A 770
LEU A 938
ILE A 963
 ECV  A1101 ( 3.9A)
ECV  A1101 (-3.1A)
ECV  A1101 ( 4.3A)
None
 0.51A 4ok1A-5mwpA:
36.3		 4ok1A-5mwpA:
21.15
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.
5npr UDP-N-ACETYLGLUCOSAM
INE--PEPTIDE
N-ACETYLGLUCOSAMINYL
TRANSFERASE 110 KDA
SUBUNIT

(Homo sapiens) 		no annotation 4 LEU A 583
ASN A 630
MET A 664
LEU A 626
 None
 1.04A 4ok1A-5nprA:
undetectable		 4ok1A-5nprA:
17.20
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.
5sv9 BOR1P BORON
TRANSPORTER

(Saccharomyces
mikatae) 		PF00955
(HCO3_cotransp) 		4 LEU A 415
MET A 425
LEU A 361
HIS A 362
 None
 0.96A 4ok1A-5sv9A:
undetectable		 4ok1A-5sv9A:
19.08
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.
5swu PENTAFUNCTIONAL AROM
POLYPEPTIDE

(Aspergillus
fumigatus) 		PF01487
(DHquinase_I) 		4 ASN A1241
MET A1285
LEU A1252
ILE A1238
 None
 0.94A 4ok1A-5swuA:
undetectable		 4ok1A-5swuA:
22.81
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.
5tf0 GLYCOSYL HYDROLASE
FAMILY 3 N-TERMINAL
DOMAIN PROTEIN

(Bacteroides
intestinalis) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C)
PF14310
(Fn3-like) 		4 LEU A  77
ASN A  52
MET A 343
ILE A 296
 None
 0.97A 4ok1A-5tf0A:
undetectable		 4ok1A-5tf0A:
14.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5w66 RNA POLYMERASE
I-SPECIFIC
TRANSCRIPTION
INITIATION FACTOR
RRN7

(Saccharomyces
cerevisiae) 		no annotation 4 LEU P 119
LEU P 172
HIS P 171
ILE P 135
 None
 1.06A 4ok1A-5w66P:
undetectable		 4ok1A-5w66P:
18.48
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.
5w7k OXAG

(Penicillium
oxalicum) 		no annotation 4 LEU A 146
MET A 108
LEU A  53
ILE A  35
 None
 1.03A 4ok1A-5w7kA:
undetectable		 4ok1A-5w7kA:
14.40
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.
5xnp LEUCINE-RICH REPEAT
AND FIBRONECTIN
TYPE-III
DOMAIN-CONTAINING
PROTEIN 5

(Homo sapiens) 		no annotation 4 LEU A 111
ASN A 133
LEU A 104
HIS A 105
 None
None
None
SO4  A 414 ( 3.8A)
 1.04A 4ok1A-5xnpA:
undetectable		 4ok1A-5xnpA:
16.81
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.
5xyi RIBOSOMAL PROTEIN
S15A
UNCHARACTERIZED
PROTEIN

(Trichomonas
vaginalis) 		PF00333
(Ribosomal_S5)
PF00410
(Ribosomal_S8)
PF03719
(Ribosomal_S5_C) 		4 LEU C 240
ASN W  70
LEU W  66
ILE W  14
 None
 0.96A 4ok1A-5xyiC:
undetectable		 4ok1A-5xyiC:
18.62
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.
6b9g ATLASTIN-1

(Homo sapiens) 		no annotation 4 ASN B 177
MET B  87
LEU B 297
ILE B 213
 None
 1.00A 4ok1A-6b9gB:
undetectable		 4ok1A-6b9gB:
17.26
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.
6by9 HISTONE-LYSINE
N-METHYLTRANSFERASE
EHMT1

(Homo sapiens) 		no annotation 4 LEU A 891
LEU A 843
HIS A 844
ILE A 878
 None
 0.97A 4ok1A-6by9A:
undetectable		 4ok1A-6by9A:
14.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6byo VOLTAGE-DEPENDENT
L-TYPE CALCIUM
CHANNEL SUBUNIT
ALPHA-1S

(Oryctolagus
cuniculus) 		no annotation 4 LEU A 472
ASN A 468
LEU A 512
ILE A 524
 None
 0.99A 4ok1A-6byoA:
1.3		 4ok1A-6byoA:
16.51
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.
6cfw MONOVALENT CATION/H+
ANTIPORTER SUBUNIT D

(Pyrococcus
furiosus) 		no annotation 4 LEU H 223
MET H 328
LEU H 324
ILE H 257
 None
 1.05A 4ok1A-6cfwH:
undetectable		 4ok1A-6cfwH:
15.62
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.
6cfz ASK1
DAD2
HSK3

(Chaetomium
thermophilum) 		no annotation 4 ASN C  41
LEU G  31
HIS G  30
ILE A  32
 None
 0.98A 4ok1A-6cfzC:
undetectable		 4ok1A-6cfzC:
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.
6cia ALDO/KETO REDUCTASE

(Klebsiella
pneumoniae) 		no annotation 4 LEU A 144
ASN A 164
MET A 109
ILE A 240
 None
None
None
NDP  A 301 (-4.7A)
 1.00A 4ok1A-6ciaA:
undetectable		 4ok1A-6ciaA:
13.20
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.
6f8l -

(-) 		no annotation 4 LEU G 439
ASN G 437
LEU G 412
ILE G 467
 None
 1.01A 4ok1A-6f8lG:
undetectable		 4ok1A-6f8lG:
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.
6fek PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE RECEPTOR RET

(Homo sapiens) 		no annotation 4 LEU A 816
MET A 984
MET A 980
ILE A 890
 None
 0.84A 4ok1A-6fekA:
undetectable		 4ok1A-6fekA:
13.20
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.
6fj4 ENDO-1,4-BETA-XYLANA
SE Y

(Ruminiclostridium
thermocellum) 		no annotation 4 ASN A 966
MET A 863
LEU A 958
ILE A 994
 None
 1.06A 4ok1A-6fj4A:
undetectable		 4ok1A-6fj4A:
16.82