SIMILAR PATTERNS OF AMINO ACIDS FOR 3QL6_A_NIMA614

List of similar pattern of amino acids derived from ASSAM search

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

(Click link on the last column to view superposed patterns of amino acids in NGL viewer)
(Note that only 3-12 residue patterns can be used for ASSAM searches)
Filter list by:
Hit Macromolecule/
Organism		 Pfam Res. Interface HETATM RMSD Dali Z-score Seq. Identity (%) View Dock
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1d7w MYELOPEROXIDASE

(Homo sapiens) 		PF03098
(An_peroxidase) 		6 GLN A  91
HIS A  95
ARG C 239
GLU C 242
PHE C 366
PRO C 220
 HEM  A 605 ( 3.4A)
CYN  A1844 (-4.1A)
HEM  A 605 (-4.3A)
HEM  A 605 (-2.1A)
None
None
 1.34A 3ql6A-1d7wA:
undetectable		 3ql6A-1d7wA:
38.17
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1d7w MYELOPEROXIDASE

(Homo sapiens) 		PF03098
(An_peroxidase) 		6 GLN A  91
HIS A  95
GLU A 102
ARG C 239
GLU C 242
PHE C 366
 HEM  A 605 ( 3.4A)
CYN  A1844 (-4.1A)
None
HEM  A 605 (-4.3A)
HEM  A 605 (-2.1A)
None
 0.69A 3ql6A-1d7wA:
undetectable		 3ql6A-1d7wA:
38.17
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1d7w MYELOPEROXIDASE

(Homo sapiens) 		PF03098
(An_peroxidase) 		6 GLN A  91
HIS A  95
GLU A 102
ARG C 239
GLU C 242
PHE C 407
 HEM  A 605 ( 3.4A)
CYN  A1844 (-4.1A)
None
HEM  A 605 (-4.3A)
HEM  A 605 (-2.1A)
HEM  A 605 (-4.5A)
 1.38A 3ql6A-1d7wA:
undetectable		 3ql6A-1d7wA:
38.17
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.
1fml RETINOL DEHYDRATASE

(Spodoptera
frugiperda) 		PF00685
(Sulfotransfer_1) 		4 GLN A 330
HIS A 218
GLU A  19
GLU A 215
 None
 1.38A 3ql6A-1fmlA:
undetectable		 3ql6A-1fmlA:
19.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1hfe PROTEIN (FE-ONLY
HYDROGENASE
(E.C.1.18.99.1)
(LARGER SUBUNIT))

(Desulfovibrio
vulgaris) 		PF02906
(Fe_hyd_lg_C)
PF13237
(Fer4_10) 		4 GLN L 174
GLU L 240
GLU L 156
PRO L 203
 None
None
None
CYN  L 428 ( 3.6A)
 1.38A 3ql6A-1hfeL:
0.0		 3ql6A-1hfeL:
21.03
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.
1hm7 PENTALENENE SYNTHASE

(Streptomyces
exfoliatus) 		no annotation 4 HIS A   8
GLU A 258
ARG A 260
GLU A 264
 None
 1.40A 3ql6A-1hm7A:
0.0		 3ql6A-1hm7A:
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.
1ijt FIBROBLAST GROWTH
FACTOR 4

(Homo sapiens) 		PF00167
(FGF) 		4 GLU A 159
ARG A 123
GLU A 122
PRO A 120
 None
 1.37A 3ql6A-1ijtA:
undetectable		 3ql6A-1ijtA:
12.41
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.
1n7g GDP-D-MANNOSE-4,6-DE
HYDRATASE

(Arabidopsis
thaliana) 		PF16363
(GDP_Man_Dehyd) 		4 GLN A 270
GLU A  54
GLU A 109
PRO A 107
 None
 1.41A 3ql6A-1n7gA:
0.0		 3ql6A-1n7gA:
20.74
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.
1q14 HST2 PROTEIN

(Saccharomyces
cerevisiae) 		PF02146
(SIR2) 		4 GLN A 304
GLU A 186
PHE A 138
PRO A 179
 None
 1.36A 3ql6A-1q14A:
undetectable		 3ql6A-1q14A:
19.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1qdb CYTOCHROME C NITRITE
REDUCTASE

(Sulfurospirillum
deleyianum) 		PF02335
(Cytochrom_C552) 		4 GLN A 106
GLU A 480
PHE A 475
PRO A 117
 None
 1.35A 3ql6A-1qdbA:
0.0		 3ql6A-1qdbA:
20.91
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.
1ty9 PHENAZINE
BIOSYNTHESIS PROTEIN
PHZG

(Pseudomonas
fluorescens) 		PF01243
(Putative_PNPOx)
PF10590
(PNP_phzG_C) 		4 GLN A  31
ARG A 219
GLU A 204
PRO A 222
 None
 1.05A 3ql6A-1ty9A:
undetectable		 3ql6A-1ty9A:
16.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1uch UBIQUITIN C-TERMINAL
HYDROLASE UCH-L3

(Homo sapiens) 		PF01088
(Peptidase_C12) 		4 HIS A 169
GLU A  70
ARG A 186
PHE A  86
 None
 1.34A 3ql6A-1uchA:
undetectable		 3ql6A-1uchA:
16.75
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.
1ugs NITRILE HYDRATASE
ALPHA SUBUNIT

(Pseudonocardia
thermophila) 		PF02979
(NHase_alpha) 		4 GLN A 130
GLU A 193
GLU A 128
PRO A 122
 None
 1.17A 3ql6A-1ugsA:
undetectable		 3ql6A-1ugsA:
15.08
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.
1vjv UBIQUITIN
CARBOXYL-TERMINAL
HYDROLASE 6

(Saccharomyces
cerevisiae) 		PF00443
(UCH) 		4 GLN A 338
GLU A 359
ARG A 361
GLU A 364
 None
 1.19A 3ql6A-1vjvA:
0.0		 3ql6A-1vjvA:
20.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1z2o INOSITOL
1,3,4-TRISPHOSPHATE
5/6-KINASE

(Entamoeba
histolytica) 		PF05770
(Ins134_P3_kin) 		4 GLN X  18
GLU X  68
PHE X  10
PRO X  47
 None
 1.30A 3ql6A-1z2oX:
undetectable		 3ql6A-1z2oX:
20.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ciy CHLOROPEROXIDASE

(Leptoxyphium
fumago) 		PF01328
(Peroxidase_2) 		4 GLN A 180
GLU A 166
ARG A 160
PRO A 253
 None
None
None
MAN  A 751 (-3.4A)
 1.40A 3ql6A-2ciyA:
undetectable		 3ql6A-2ciyA:
19.00
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.
2e80 CYTOCHROME C-552

(Wolinella
succinogenes) 		PF02335
(Cytochrom_C552) 		4 GLN A 107
GLU A 474
PHE A 469
PRO A 118
 None
 1.34A 3ql6A-2e80A:
undetectable		 3ql6A-2e80A:
20.03
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2gjm LACTOPEROXIDASE

(Bubalus bubalis) 		PF03098
(An_peroxidase) 		7 GLN A  91
HIS A  95
GLU A 102
ARG A 239
GLU A 242
PHE A 366
PRO A 409
 HEM  A 605 (-3.4A)
SCN  A1502 ( 4.8A)
None
HEM  A 605 (-4.7A)
HEM  A 605 ( 2.2A)
None
None
 0.64A 3ql6A-2gjmA:
60.6		 3ql6A-2gjmA:
99.66
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.
2i82 RIBOSOMAL LARGE
SUBUNIT
PSEUDOURIDINE
SYNTHASE A

(Escherichia
coli) 		PF00849
(PseudoU_synth_2) 		4 GLN A 125
HIS A 162
ARG A 165
PRO A 156
 A  E1211 ( 3.7A)
G  E1210 ( 3.8A)
None
None
 1.42A 3ql6A-2i82A:
undetectable		 3ql6A-2i82A:
17.36
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.
2jir PERIPLASMIC NITRATE
REDUCTASE

(Desulfovibrio
desulfuricans) 		PF00384
(Molybdopterin)
PF01568
(Molydop_binding)
PF04879
(Molybdop_Fe4S4) 		4 HIS A  41
ARG A 477
PHE A 341
PRO A 157
 None
 1.33A 3ql6A-2jirA:
undetectable		 3ql6A-2jirA:
21.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2o0r RV0858C
(N-SUCCINYLDIAMINOPI
MELATE
AMINOTRANSFERASE)

(Mycobacterium
tuberculosis) 		PF00155
(Aminotran_1_2) 		4 GLN A  73
HIS A  77
GLU A 202
PRO A 168
 None
 1.15A 3ql6A-2o0rA:
undetectable		 3ql6A-2o0rA:
21.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2o1v ENDOPLASMIN

(Canis lupus) 		PF00183
(HSP90)
PF02518
(HATPase_c) 		4 GLU A 365
GLU A 487
PHE A 488
PRO A 390
 None
 1.09A 3ql6A-2o1vA:
undetectable		 3ql6A-2o1vA:
21.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2o1w ENDOPLASMIN

(Canis lupus) 		PF00183
(HSP90)
PF02518
(HATPase_c) 		4 GLU A 365
GLU A 487
PHE A 488
PRO A 390
 None
 1.03A 3ql6A-2o1wA:
undetectable		 3ql6A-2o1wA:
20.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2og9 MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME

(Polaromonas sp.
JS666) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 GLU A 349
ARG A 347
GLU A 346
PRO A 358
 None
 1.24A 3ql6A-2og9A:
1.2		 3ql6A-2og9A:
20.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qnk 3-HYDROXYANTHRANILAT
E 3,4-DIOXYGENASE

(Homo sapiens) 		PF06052
(3-HAO) 		4 HIS A  91
GLU A 129
PHE A 170
PRO A 169
 NI  A 287 (-3.3A)
None
None
None
 1.35A 3ql6A-2qnkA:
undetectable		 3ql6A-2qnkA:
19.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2tmk THYMIDYLATE KINASE

(Saccharomyces
cerevisiae) 		PF02223
(Thymidylate_kin) 		4 GLU A 149
ARG A 150
PHE A  69
PRO A  39
 ATM  A 217 ( 4.9A)
None
ATM  A 217 (-3.5A)
ATM  A 217 ( 4.2A)
 1.40A 3ql6A-2tmkA:
undetectable		 3ql6A-2tmkA:
16.78
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.
2y3a PHOSPHATIDYLINOSITOL
-4,5-BISPHOSPHATE
3-KINASE CATALYTIC
SUBUNIT BETA ISOFORM

(Mus musculus) 		PF00454
(PI3_PI4_kinase)
PF00613
(PI3Ka)
PF00792
(PI3K_C2)
PF00794
(PI3K_rbd)
PF02192
(PI3K_p85B) 		4 GLN A 631
GLU A 249
PHE A 667
PRO A 758
 None
 1.07A 3ql6A-2y3aA:
undetectable		 3ql6A-2y3aA:
20.24
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.
2y8n 4-HYDROXYPHENYLACETA
TE DECARBOXYLASE
LARGE SUBUNIT

(Clostridium
scatologenes) 		PF01228
(Gly_radical)
PF02901
(PFL-like) 		4 GLN A 845
HIS A 843
GLU A 637
PHE A 405
 None
 1.20A 3ql6A-2y8nA:
undetectable		 3ql6A-2y8nA:
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.
2ycd GLUTATHIONE
S-TRANSFERASE

(Agrobacterium
tumefaciens) 		PF02798
(GST_N)
PF13410
(GST_C_2) 		4 GLU A 136
ARG A 137
GLU A 143
PRO A 140
 None
 1.40A 3ql6A-2ycdA:
undetectable		 3ql6A-2ycdA:
17.36
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.
2zbt PYRIDOXAL
BIOSYNTHESIS LYASE
PDXS

(Thermus
thermophilus) 		PF01680
(SOR_SNZ) 		4 GLU A  49
ARG A  63
GLU A  92
PRO A  67
 None
 1.20A 3ql6A-2zbtA:
undetectable		 3ql6A-2zbtA:
18.97
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.
3ahm OLIGOPEPTIDASE

(Geobacillus sp.
MO-1) 		no annotation 4 GLU A  73
GLU A  81
PHE A  50
PRO A  11
 None
 1.40A 3ql6A-3ahmA:
undetectable		 3ql6A-3ahmA:
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.
3av6 DNA
(CYTOSINE-5)-METHYLT
RANSFERASE 1

(Mus musculus) 		PF00145
(DNA_methylase)
PF01426
(BAH)
PF02008
(zf-CXXC)
PF12047
(DNMT1-RFD) 		4 GLN A 374
HIS A 376
GLU A 383
PRO A 466
 None
 1.39A 3ql6A-3av6A:
undetectable		 3ql6A-3av6A:
18.11
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.
3ayx MEMBRANE-BOUND
HYDROGENASE LARGE
SUBUNIT
MEMBRANE-BOUND
HYDROGENASE SMALL
SUBUNIT

(Hydrogenovibrio
marinus) 		PF00374
(NiFeSe_Hases)
PF01058
(Oxidored_q6)
PF14720
(NiFe_hyd_SSU_C) 		4 HIS A 117
GLU A  73
GLU B  28
PRO B 159
 None
None
None
F4S  B 301 ( 4.8A)
 1.20A 3ql6A-3ayxA:
undetectable		 3ql6A-3ayxA:
23.51
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.
3d19 CONSERVED
METALLOPROTEIN

(Bacillus cereus) 		PF11155
(DUF2935) 		4 HIS A 255
GLU A  26
GLU A 128
PHE A 157
 FE  A 302 (-3.5A)
None
FE  A 302 ( 2.4A)
None
 1.38A 3ql6A-3d19A:
undetectable		 3ql6A-3d19A:
19.50
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.
3d3l ARACHIDONATE
12-LIPOXYGENASE,
12S-TYPE

(Homo sapiens) 		PF00305
(Lipoxygenase) 		4 HIS A 462
GLU A 643
ARG A 641
GLU A 637
 None
 1.28A 3ql6A-3d3lA:
1.1		 3ql6A-3d3lA:
20.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3dwb ENDOTHELIN-CONVERTIN
G ENZYME 1

(Homo sapiens) 		PF01431
(Peptidase_M13)
PF05649
(Peptidase_M13_N) 		4 GLN A 548
GLU A 575
PHE A 509
PRO A 507
 5HD  A 816 ( 4.7A)
None
5HD  A 816 ( 3.9A)
None
 1.37A 3ql6A-3dwbA:
undetectable		 3ql6A-3dwbA:
22.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ekg MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME

(Azotobacter
vinelandii) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 GLU A 242
GLU A 272
PHE A 278
PRO A 292
 MG  A 601 ( 3.0A)
None
None
None
 1.31A 3ql6A-3ekgA:
0.2		 3ql6A-3ekgA:
22.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gi8 UNCHARACTERIZED
PROTEIN MJ0609

(Methanocaldococcus
jannaschii) 		PF13520
(AA_permease_2) 		4 GLU C 212
ARG C 314
PHE C 318
PRO C 309
 None
 1.35A 3ql6A-3gi8C:
undetectable		 3ql6A-3gi8C:
21.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3kal HOMOGLUTATHIONE
SYNTHETASE

(Glycine max) 		PF03199
(GSH_synthase)
PF03917
(GSH_synth_ATP) 		4 GLN A 338
GLU A 347
GLU A 339
PHE A 113
 None
 1.27A 3ql6A-3kalA:
undetectable		 3ql6A-3kalA:
23.99
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.
3m4x NOL1/NOP2/SUN FAMILY
PROTEIN

(Enterococcus
faecium) 		PF01189
(Methyltr_RsmB-F)
PF13636
(Methyltranf_PUA)
PF17125
(Methyltr_RsmF_N)
PF17126
(RsmF_methylt_CI) 		4 HIS A  82
ARG A 152
PHE A 449
PRO A 450
 None
 1.08A 3ql6A-3m4xA:
undetectable		 3ql6A-3m4xA:
21.53
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.
3m7d TOPOISOMERASE V

(Methanopyrus
kandleri) 		PF13412
(HTH_24) 		4 GLU A 194
GLU A 171
PHE A 170
PRO A 196
 None
 1.36A 3ql6A-3m7dA:
1.4		 3ql6A-3m7dA:
21.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3n0q PUTATIVE
AROMATIC-RING
HYDROXYLATING
DIOXYGENASE

(Ruegeria sp.
TM1040) 		PF00355
(Rieske)
PF00848
(Ring_hydroxyl_A) 		4 GLN A 254
HIS A 296
PHE A  37
PRO A 316
 None
 1.39A 3ql6A-3n0qA:
undetectable		 3ql6A-3n0qA:
21.85
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.
3n3u ADENOSINE
MONOPHOSPHATE-PROTEI
N TRANSFERASE IBPA

(Histophilus
somni) 		PF02661
(Fic) 		4 GLN A3643
GLU A3646
PHE A3719
PRO A3718
 None
 1.05A 3ql6A-3n3uA:
undetectable		 3ql6A-3n3uA:
19.40
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.
3no5 UNCHARACTERIZED
PROTEIN

(Cupriavidus
pinatubonensis) 		PF05853
(BKACE) 		4 GLN A  81
HIS A  47
GLU A 143
PHE A 145
 None
ZN  A 275 (-3.3A)
None
None
 1.35A 3ql6A-3no5A:
undetectable		 3ql6A-3no5A:
18.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3nsj PERFORIN-1

(Mus musculus) 		PF00168
(C2)
PF01823
(MACPF) 		4 HIS A  93
GLU A 343
ARG A 181
PRO A 186
 None
 1.11A 3ql6A-3nsjA:
undetectable		 3ql6A-3nsjA:
22.05
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.
3sun DNA POLYMERASE

(Escherichia
virus RB69) 		PF00136
(DNA_pol_B)
PF03104
(DNA_pol_B_exo1) 		4 GLN A 354
GLU A  26
GLU A   9
PRO A 244
 None
 1.22A 3ql6A-3sunA:
0.0		 3ql6A-3sunA:
20.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3tp2 PRE-MRNA-SPLICING
FACTOR CWC2

(Saccharomyces
cerevisiae) 		PF00076
(RRM_1)
PF16131
(Torus) 		4 GLN A  12
HIS A  58
PHE A 194
PRO A  94
 None
 1.39A 3ql6A-3tp2A:
undetectable		 3ql6A-3tp2A:
17.36
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.
3w21 PUTATIVE
UNCHARACTERIZED
PROTEIN

(Burkholderia
ambifaria) 		no annotation 4 HIS A 155
GLU A 249
PHE A 181
PRO A 232
 ZN  A 301 ( 3.4A)
None
AKG  A 302 (-3.5A)
None
 1.37A 3ql6A-3w21A:
undetectable		 3ql6A-3w21A:
19.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3wuc GALECTIN

(Xenopus laevis) 		PF00337
(Gal-bind_lectin) 		4 HIS A 135
GLU A 107
ARG A  19
GLU A  21
 None
 1.37A 3ql6A-3wucA:
undetectable		 3ql6A-3wucA:
14.26
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.
4ci6 PROTEIN KINASE YOPO

(Yersinia
enterocolitica) 		PF00069
(Pkinase)
PF09632
(Rac1) 		4 HIS B 249
GLU B 318
ARG B 400
PRO B 394
 None
 1.26A 3ql6A-4ci6B:
undetectable		 3ql6A-4ci6B:
22.91
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.
4cw4 BETA-KETOACYL
SYNTHASE

(Pseudomonas
aeruginosa) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		4 HIS A  23
GLU A  73
GLU A  40
PRO A  69
 None
 1.28A 3ql6A-4cw4A:
undetectable		 3ql6A-4cw4A:
23.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4h2x AMINO
ACID--[ACYL-CARRIER-
PROTEIN] LIGASE 1

(Agrobacterium
fabrum;
Bradyrhizobium
diazoefficiens) 		no annotation 4 HIS B 257
GLU B 237
PHE B  85
PRO B 216
 None
 1.34A 3ql6A-4h2xB:
0.3		 3ql6A-4h2xB:
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.
4j5t MANNOSYL-OLIGOSACCHA
RIDE GLUCOSIDASE

(Saccharomyces
cerevisiae) 		PF03200
(Glyco_hydro_63)
PF16923
(Glyco_hydro_63N) 		4 GLN A 447
GLU A 393
GLU A 429
PRO A 380
 None
 1.35A 3ql6A-4j5tA:
undetectable		 3ql6A-4j5tA:
22.70
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.
4k2b NTD BIOSYNTHESIS
OPERON PROTEIN NTDA

(Bacillus
subtilis) 		PF01041
(DegT_DnrJ_EryC1) 		4 ARG A 426
GLU A 423
PHE A 419
PRO A 414
 None
 1.32A 3ql6A-4k2bA:
undetectable		 3ql6A-4k2bA:
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.
4nre ARACHIDONATE
15-LIPOXYGENASE B

(Homo sapiens) 		PF00305
(Lipoxygenase)
PF01477
(PLAT) 		4 GLN A 560
HIS A 373
GLU A 671
PRO A 614
 None
C8E  A 702 ( 3.5A)
GOL  A 718 ( 4.8A)
None
 1.20A 3ql6A-4nreA:
undetectable		 3ql6A-4nreA:
23.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4p1l TRAP DICARBOXYLATE
TRANSPORTER, DCTP
SUBUNIT

(Chromohalobacter
salexigens) 		PF03480
(DctP) 		4 GLU A 244
ARG A 276
GLU A 280
PRO A  47
 BDP  A 401 (-3.0A)
None
None
None
 1.37A 3ql6A-4p1lA:
undetectable		 3ql6A-4p1lA:
18.84
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.
4ru0 PUTATIVE
BRANCHED-CHAIN AMINO
ACID ABC
TRANSPORTER,
PERIPLASMIC
BRANCHED-CHAIN AMINO
ACID-BINDING PROTEIN

(Pseudomonas
protegens) 		PF13458
(Peripla_BP_6) 		4 HIS A 361
GLU A 360
PHE A 148
PRO A 127
 None
 1.07A 3ql6A-4ru0A:
undetectable		 3ql6A-4ru0A:
22.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4uek GALACTITOL-1-PHOSPHA
TE 5-DEHYDROGENASE

(Escherichia
coli) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		4 GLN A 297
ARG A 304
GLU A 300
PRO A 132
 None
 1.23A 3ql6A-4uekA:
undetectable		 3ql6A-4uekA:
22.13
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.
4wxx DNA
(CYTOSINE-5)-METHYLT
RANSFERASE 1

(Homo sapiens) 		PF00145
(DNA_methylase)
PF01426
(BAH)
PF02008
(zf-CXXC)
PF12047
(DNMT1-RFD) 		4 GLU A 877
GLU A1322
PHE A1262
PRO A1325
 None
 1.35A 3ql6A-4wxxA:
undetectable		 3ql6A-4wxxA:
19.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4wxz PYRIDOXAL
BIOSYNTHESIS LYASE
PDXS

(Geobacillus
kaustophilus) 		PF01680
(SOR_SNZ) 		4 GLU A  46
ARG A  60
GLU A  89
PRO A  64
 None
 1.35A 3ql6A-4wxzA:
undetectable		 3ql6A-4wxzA:
19.12
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.
4x8d SULFOXIDE SYNTHASE
EGTB

(Mycolicibacterium
thermoresistibile) 		PF03781
(FGE-sulfatase)
PF12867
(DinB_2) 		4 GLN A  55
HIS A 134
PHE A  83
PRO A 383
 CL  A 510 ( 4.6A)
MN  A 503 ( 3.3A)
None
None
 1.25A 3ql6A-4x8dA:
undetectable		 3ql6A-4x8dA:
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.
5a8d CARBOHYDRATE BINDING
FAMILY 6

(Ruminiclostridium
thermocellum) 		PF04616
(Glyco_hydro_43) 		4 GLN A  38
HIS A 272
GLU A 242
GLU A 215
 None
 1.35A 3ql6A-5a8dA:
undetectable		 3ql6A-5a8dA:
19.76
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.
5aa5 NIFE-HYDROGENASE
LARGE SUBUNIT, HOFG
NIFE-HYDROGENASE
SMALL SUBUNIT, HOFK

(Cupriavidus
necator) 		PF00374
(NiFeSe_Hases)
PF01058
(Oxidored_q6)
PF14720
(NiFe_hyd_SSU_C) 		4 GLN C 355
HIS C 519
PHE C  58
PRO A 158
 None
 1.09A 3ql6A-5aa5C:
undetectable		 3ql6A-5aa5C:
21.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5c08 1E6 TCR ALPHA CHAIN
1E6 TCR BETA CHAIN

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set)
PF09291
(DUF1968) 		4 GLN E  37
GLU D   5
ARG E  41
PRO D   8
 None
 1.32A 3ql6A-5c08E:
undetectable		 3ql6A-5c08E:
17.83
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.
5do8 LMO0184 PROTEIN

(Listeria
monocytogenes) 		no annotation 4 GLN B  14
HIS B 327
PHE B 280
PRO B 256
 None
BGC  B 601 (-3.9A)
BTB  B 603 (-4.0A)
BTB  B 603 (-4.6A)
 1.27A 3ql6A-5do8B:
undetectable		 3ql6A-5do8B:
20.57
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.
5egw CYSTEINE PROTEASE

(Ambrosia
artemisiifolia) 		PF00112
(Peptidase_C1)
PF08246
(Inhibitor_I29) 		4 HIS A  26
GLU A  34
ARG A  28
GLU A  31
 None
 1.27A 3ql6A-5egwA:
undetectable		 3ql6A-5egwA:
20.76
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.
5eo7 PREDICTED PROTEIN

(Aspergillus
oryzae) 		PF07938
(Fungal_lectin) 		4 GLN A 249
HIS A 252
PHE A 220
PRO A 274
 None
None
SFU  A 404 ( 4.2A)
SFU  A 404 ( 4.2A)
 1.39A 3ql6A-5eo7A:
undetectable		 3ql6A-5eo7A:
20.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5h64 SERINE/THREONINE-PRO
TEIN KINASE MTOR

(Homo sapiens) 		PF00454
(PI3_PI4_kinase)
PF02259
(FAT)
PF02260
(FATC)
PF08771
(FRB_dom)
PF11865
(DUF3385) 		4 HIS A2355
GLU A2373
ARG A2339
PRO A2376
 None
 1.39A 3ql6A-5h64A:
undetectable		 3ql6A-5h64A:
13.00
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.
5h6s AMIDASE

(Microbacterium
sp. HM58-2) 		PF01425
(Amidase) 		4 HIS A 434
GLU A 254
GLU A 436
PHE A 234
 None
 1.35A 3ql6A-5h6sA:
undetectable		 3ql6A-5h6sA:
22.90
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.
5h80 CARBOXYLASE

(Deinococcus
radiodurans) 		PF00289
(Biotin_carb_N)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2) 		4 HIS A 295
GLU A  18
ARG A  16
GLU A  12
 None
 1.33A 3ql6A-5h80A:
undetectable		 3ql6A-5h80A:
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.
5k0w CLASS B
CARBAPENEMASE GOB-18

(Elizabethkingia
meningoseptica) 		PF00753
(Lactamase_B) 		4 GLN A  98
HIS A 103
GLU A  72
PRO A  28
 ZN  A 302 ( 2.6A)
ZN  A 301 (-3.3A)
None
None
 1.39A 3ql6A-5k0wA:
undetectable		 3ql6A-5k0wA:
19.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5l56 PLEXIN-A1

(Mus musculus) 		PF01403
(Sema)
PF01437
(PSI)
PF01833
(TIG) 		4 HIS A 156
GLU A 155
PHE A 216
PRO A 197
 None
 1.12A 3ql6A-5l56A:
undetectable		 3ql6A-5l56A:
19.64
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5mfa MYELOPEROXIDASE

(Homo sapiens) 		PF03098
(An_peroxidase) 		5 GLN A 257
HIS A 261
ARG A 405
PHE A 532
PRO A 386
 HEM  A 812 (-3.3A)
None
HEM  A 812 (-3.7A)
TRS  A 824 ( 4.8A)
TRS  A 824 ( 4.6A)
 1.34A 3ql6A-5mfaA:
54.7		 3ql6A-5mfaA:
49.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5mfa MYELOPEROXIDASE

(Homo sapiens) 		PF03098
(An_peroxidase) 		4 GLN A 257
HIS A 261
ARG A 405
PHE A 573
 HEM  A 812 (-3.3A)
None
HEM  A 812 (-3.7A)
HEM  A 812 ( 3.9A)
 0.84A 3ql6A-5mfaA:
54.7		 3ql6A-5mfaA:
49.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5mfa MYELOPEROXIDASE

(Homo sapiens) 		PF03098
(An_peroxidase) 		5 GLN A 257
HIS A 261
GLU A 268
ARG A 405
PHE A 532
 HEM  A 812 (-3.3A)
None
HEM  A 812 ( 4.9A)
HEM  A 812 (-3.7A)
TRS  A 824 ( 4.8A)
 0.73A 3ql6A-5mfaA:
54.7		 3ql6A-5mfaA:
49.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5mfa MYELOPEROXIDASE

(Homo sapiens) 		PF03098
(An_peroxidase) 		4 HIS A 261
GLU A 408
PHE A 532
PRO A 386
 None
HEM  A 812 (-4.2A)
TRS  A 824 ( 4.8A)
TRS  A 824 ( 4.6A)
 1.32A 3ql6A-5mfaA:
54.7		 3ql6A-5mfaA:
49.78
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.
5mgz 8-DEMETHYLNOVOBIOCIC
ACID
C(8)-METHYLTRANSFERA
SE

(Streptomyces
niveus) 		PF13649
(Methyltransf_25) 		4 HIS A 120
GLU A  27
PHE A 153
PRO A 219
 ACT  A 303 (-4.0A)
None
None
None
 1.42A 3ql6A-5mgzA:
undetectable		 3ql6A-5mgzA:
17.59
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.
5mhf MANNOSYL-OLIGOSACCHA
RIDE GLUCOSIDASE

(Mus musculus) 		no annotation 4 GLN A 502
GLU A 449
GLU A 484
PRO A 436
 None
None
6A9  A 903 ( 3.9A)
6A9  A 903 (-4.3A)
 1.42A 3ql6A-5mhfA:
undetectable		 3ql6A-5mhfA:
8.60
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.
5n2u NUCLEOPROTEIN

(Influenza D
virus) 		no annotation 4 GLN A 432
ARG A 433
PHE A 231
PRO A 232
 None
 1.32A 3ql6A-5n2uA:
undetectable		 3ql6A-5n2uA:
10.59
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.
5n8o DNA HELICASE I

(Escherichia
coli) 		PF07057
(TraI)
PF08751
(TrwC)
PF13604
(AAA_30) 		4 GLN A 866
GLU A1327
ARG A1275
GLU A1323
 None
 1.19A 3ql6A-5n8oA:
undetectable		 3ql6A-5n8oA:
16.31
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.
5olc GALACTONATE
DEHYDRATASE

(Zobellia
galactanivorans) 		no annotation 4 GLU A 220
GLU A 248
PHE A 254
PRO A 268
 None
 1.21A 3ql6A-5olcA:
undetectable		 3ql6A-5olcA:
10.32
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.
5t67 SUGAR 3-C-METHYL
TRANSFERASE

(Actinomadura
kijaniata) 		PF08421
(Methyltransf_13)
PF08484
(Methyltransf_14)
PF13489
(Methyltransf_23) 		4 ARG A 398
GLU A 394
PHE A 371
PRO A 376
 None
 1.42A 3ql6A-5t67A:
undetectable		 3ql6A-5t67A:
21.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5tuc SUS TBC1D15 GAP
DOMAIN

(Sus scrofa) 		PF00566
(RabGAP-TBC) 		4 GLN A 323
GLU A 584
ARG A 327
PHE A 544
 None
 1.41A 3ql6A-5tucA:
undetectable		 3ql6A-5tucA:
19.73
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.
5tz8 GLYCOSYL TRANSFERASE

(Staphylococcus
aureus) 		PF00535
(Glycos_transf_2) 		4 GLN A 537
GLU A 458
PHE A 362
PRO A 474
 None
 1.08A 3ql6A-5tz8A:
undetectable		 3ql6A-5tz8A:
20.75
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.
5u02 GLYCOSYL TRANSFERASE

(Staphylococcus
aureus) 		no annotation 4 GLN A 537
GLU A 458
PHE A 362
PRO A 474
 None
IMD  A 601 (-3.0A)
None
None
 1.06A 3ql6A-5u02A:
undetectable		 3ql6A-5u02A:
19.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5u30 CRISPR-ASSOCIATED
ENDONUCLEASE C2C1

(Alicyclobacillus
acidoterrestris) 		no annotation 4 GLN A 996
ARG A1079
PHE A 901
PRO A 908
 None
 1.30A 3ql6A-5u30A:
undetectable		 3ql6A-5u30A:
20.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ucd NAD(P)-DEPENDENT
BENZALDEHYDE
DEHYDROGENASE

(Pseudomonas
putida) 		PF00171
(Aldedh) 		4 GLU A  75
GLU A 215
PHE A 190
PRO A 129
 None
NAP  A 501 (-4.0A)
None
None
 1.42A 3ql6A-5ucdA:
undetectable		 3ql6A-5ucdA:
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.
5uiv BIFUNCTIONAL
THYMIDYLATE/URIDYLAT
E KINASE

(Candida
albicans) 		PF02223
(Thymidylate_kin) 		4 GLU A 159
ARG A 160
PHE A  67
PRO A  37
 TMP  A 301 ( 4.5A)
None
TMP  A 301 (-3.1A)
TMP  A 301 ( 4.4A)
 1.32A 3ql6A-5uivA:
undetectable		 3ql6A-5uivA:
20.91
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.
5weo GLUTAMATE RECEPTOR
2,VOLTAGE-DEPENDENT
CALCIUM CHANNEL
GAMMA-2 SUBUNIT
CHIMERA

(Mus musculus;
Rattus
norvegicus) 		PF00060
(Lig_chan)
PF00822
(PMP22_Claudin)
PF01094
(ANF_receptor)
PF10613
(Lig_chan-Glu_bd) 		4 GLN A  24
GLU A  25
PHE A  76
PRO A  99
 None
 1.28A 3ql6A-5weoA:
undetectable		 3ql6A-5weoA:
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.
5wso NS3 HELICASE

(Pestivirus A) 		no annotation 4 HIS A 595
GLU A 651
PHE A 614
PRO A 642
 None
 1.39A 3ql6A-5wsoA:
undetectable		 3ql6A-5wsoA:
9.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5xgj PHOSPHATIDYLINOSITOL
4,5-BISPHOSPHATE
3-KINASE CATALYTIC
SUBUNIT ALPHA
ISOFORM

(Homo sapiens) 		no annotation 4 GLN A 630
GLU A 259
PHE A 666
PRO A 757
 None
 1.35A 3ql6A-5xgjA:
undetectable		 3ql6A-5xgjA:
8.09
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.
5xvs GDP/UDP-N,N'-DIACETY
LBACILLOSAMINE
2-EPIMERASE
(HYDROLYZING)

(Acinetobacter
baumannii) 		no annotation 4 GLN A 310
GLU A 155
ARG A 315
PRO A 350
 UDP  A 402 (-4.0A)
None
None
None
 1.40A 3ql6A-5xvsA:
undetectable		 3ql6A-5xvsA:
8.29
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.
6azp MYELOPEROXIDASE

(Homo sapiens) 		no annotation 5 GLN A 257
HIS A 261
ARG A 405
PHE A 532
PRO A 386
 None
 1.39A 3ql6A-6azpA:
55.0		 3ql6A-6azpA:
11.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6azp MYELOPEROXIDASE

(Homo sapiens) 		no annotation 5 GLN A 257
HIS A 261
GLU A 268
ARG A 405
PHE A 532
 None
 0.86A 3ql6A-6azpA:
55.0		 3ql6A-6azpA:
11.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6azp MYELOPEROXIDASE

(Homo sapiens) 		no annotation 5 GLN A 257
HIS A 261
GLU A 268
ARG A 405
PHE A 573
 None
 1.19A 3ql6A-6azpA:
55.0		 3ql6A-6azpA:
11.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6caj TRANSLATION
INITIATION FACTOR
EIF-2B SUBUNIT BETA

(Homo sapiens) 		no annotation 4 ARG C 172
GLU C  32
PHE C 272
PRO C 270
 None
 1.28A 3ql6A-6cajC:
undetectable		 3ql6A-6cajC:
8.11
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.
6erc PEROXINECTIN A

(Dictyostelium
discoideum) 		no annotation 5 GLN A  97
HIS A 101
ARG A 233
GLU A 236
PHE A 352
 HEM  A 604 (-3.4A)
None
HEM  A 604 (-3.1A)
HEM  A 604 (-2.2A)
None
 0.80A 3ql6A-6ercA:
39.8		 3ql6A-6ercA:
9.17
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.
6f0k CYTOCHROME C FAMILY
PROTEIN
QUINOL:CYTOCHROME C
OXIDOREDUCTASE
MONOHEME CYTOCHROME
SUBUNIT

(Rhodothermus
marinus) 		no annotation 4 GLN A 173
ARG E 105
GLU A  69
PRO E 173
 None
 1.31A 3ql6A-6f0kA:
undetectable		 3ql6A-6f0kA:
8.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6f5o POLYMERASE ACIDIC
PROTEIN
POLYMERASE BASIC
PROTEIN 2
RNA-DIRECTED RNA
POLYMERASE CATALYTIC
SUBUNIT

(Influenza B
virus) 		no annotation 4 GLN C 664
GLU B 485
ARG A 671
PRO A 674
 None
 1.35A 3ql6A-6f5oC:
undetectable		 3ql6A-6f5oC:
11.89
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.
6fd2 PUTATIVE APRAMYCIN
BIOSYNTHETIC
OXIDOREDUCTASE 4

(Streptoalloteichus
tenebrarius) 		no annotation 4 GLN B 446
HIS B 450
ARG B 358
PRO B 311
 None
 1.36A 3ql6A-6fd2B:
undetectable		 3ql6A-6fd2B:
8.76