SIMILAR PATTERNS OF AMINO ACIDS FOR 1HRK_B_CHDB2501_0

List of similar pattern of amino acids derived from ASSAM search

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

(Click link on the last column to view superposed patterns of amino acids in NGL viewer)
(Note that only 3-12 residue patterns can be used for ASSAM searches)
Filter list by:
Hit Macromolecule/
Organism		 Pfam Res. Interface HETATM RMSD Dali Z-score Seq. Identity (%) View Dock
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1b41 ACETYLCHOLINESTERASE

(Homo sapiens) 		PF00135
(COesterase) 		5 LEU A 159
PHE A  47
LEU A 161
PRO A 258
VAL A 255
 None
 1.28A 1hrkB-1b41A:
2.6		 1hrkB-1b41A:
21.76
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.
1fk8 3ALPHA-HYDROXYSTEROI
D
DEHYDROGENASE/CARBON
YL REDUCTASE

(Comamonas
testosteroni) 		PF00106
(adh_short)
PF13561
(adh_short_C2) 		5 LEU A  66
PHE A  97
LEU A  68
ILE A   3
VAL A  38
 None
 1.43A 1hrkB-1fk8A:
3.7		 1hrkB-1fk8A:
21.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1gz0 HYPOTHETICAL
TRNA/RRNA
METHYLTRANSFERASE
YJFH

(Escherichia
coli) 		PF00588
(SpoU_methylase)
PF08032
(SpoU_sub_bind) 		5 LEU A 164
LEU A  85
PRO A 150
ARG A  78
VAL A 121
 None
 1.24A 1hrkB-1gz0A:
2.1		 1hrkB-1gz0A:
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.
1h4o PEROXIREDOXIN 5

(Homo sapiens) 		PF08534
(Redoxin) 		5 LEU A  73
ILE A 157
PRO A  10
VAL A  12
VAL A 137
 None
 1.42A 1hrkB-1h4oA:
undetectable		 1hrkB-1h4oA:
20.13
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.
1jax CONSERVED
HYPOTHETICAL PROTEIN

(Archaeoglobus
fulgidus) 		PF03807
(F420_oxidored) 		5 LEU A  16
PHE A 140
LEU A  12
VAL A  98
VAL A 151
 None
 1.43A 1hrkB-1jaxA:
3.5		 1hrkB-1jaxA:
22.65
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1lbq FERROCHELATASE

(Saccharomyces
cerevisiae) 		PF00762
(Ferrochelatase) 		5 ILE A 313
PRO A 238
VAL A 241
VAL A 277
TRP A 282
 None
 1.09A 1hrkB-1lbqA:
48.3		 1hrkB-1lbqA:
49.33
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1lbq FERROCHELATASE

(Saccharomyces
cerevisiae) 		PF00762
(Ferrochelatase) 		8 LEU A  62
PHE A  63
ILE A  91
HIS A 235
PRO A 238
VAL A 241
VAL A 277
TRP A 282
 None
 0.43A 1hrkB-1lbqA:
48.3		 1hrkB-1lbqA:
49.33
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1lbq FERROCHELATASE

(Saccharomyces
cerevisiae) 		PF00762
(Ferrochelatase) 		5 MET A  46
HIS A 235
PRO A 238
VAL A 241
TRP A 282
 None
 1.06A 1hrkB-1lbqA:
48.3		 1hrkB-1lbqA:
49.33
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1lbq FERROCHELATASE

(Saccharomyces
cerevisiae) 		PF00762
(Ferrochelatase) 		5 PHE A  63
LEU A  68
HIS A 235
VAL A 277
TRP A 282
 None
 1.28A 1hrkB-1lbqA:
48.3		 1hrkB-1lbqA:
49.33
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.
1qi7 PROTEIN
(N-GLYCOSIDASE)

(Saponaria
officinalis) 		PF00161
(RIP) 		5 LEU A  64
PHE A  55
ILE A 169
VAL A  27
VAL A 177
 None
 1.21A 1hrkB-1qi7A:
undetectable		 1hrkB-1qi7A:
21.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1vqz LIPOATE-PROTEIN
LIGASE, PUTATIVE

(Streptococcus
pneumoniae) 		PF03099
(BPL_LplA_LipB)
PF10437
(Lip_prot_lig_C) 		5 MET A 205
LEU A 201
PHE A 197
LEU A  34
ILE A 106
 None
 1.20A 1hrkB-1vqzA:
undetectable		 1hrkB-1vqzA:
20.97
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.
1wa5 IMPORTIN ALPHA
RE-EXPORTER

(Saccharomyces
cerevisiae) 		PF03378
(CAS_CSE1)
PF03810
(IBN_N)
PF08506
(Cse1) 		5 LEU C  41
PHE C  61
LEU C  38
ILE C 109
PRO C  79
 None
 1.21A 1hrkB-1wa5C:
undetectable		 1hrkB-1wa5C:
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.
1yir NICOTINATE
PHOSPHORIBOSYLTRANSF
ERASE 2

(Pseudomonas
aeruginosa) 		PF04095
(NAPRTase) 		5 LEU A  92
PHE A  88
LEU A  78
ILE A 123
PRO A 220
 None
 1.07A 1hrkB-1yirA:
undetectable		 1hrkB-1yirA:
22.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2a3l AMP DEAMINASE

(Arabidopsis
thaliana) 		PF00962
(A_deaminase) 		5 PRO A 722
VAL A 723
ARG A 727
VAL A 758
TRP A 759
 None
 1.34A 1hrkB-2a3lA:
undetectable		 1hrkB-2a3lA:
18.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2cvt RIBONUCLEOSIDE-DIPHO
SPHATE REDUCTASE
LARGE CHAIN 1

(Saccharomyces
cerevisiae) 		PF00317
(Ribonuc_red_lgN)
PF02867
(Ribonuc_red_lgC)
PF03477
(ATP-cone) 		5 MET A 606
LEU A 512
PHE A 516
LEU A 450
ILE A 695
 None
 1.42A 1hrkB-2cvtA:
undetectable		 1hrkB-2cvtA:
17.44
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.
2dpp NITRILE HYDRATASE
ALPHA SUBUNIT

(Bacillus sp.
RAPc8) 		PF02979
(NHase_alpha) 		5 LEU A 127
ILE A 173
PRO A 179
VAL A 197
VAL A 104
 None
 1.41A 1hrkB-2dppA:
undetectable		 1hrkB-2dppA:
18.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2dyl DUAL SPECIFICITY
MITOGEN-ACTIVATED
PROTEIN KINASE
KINASE 7

(Homo sapiens) 		PF00069
(Pkinase) 		5 LEU A 331
LEU A 235
MET A 238
VAL A 404
VAL A 413
 None
 1.26A 1hrkB-2dylA:
undetectable		 1hrkB-2dylA:
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.
2fej CELLULAR TUMOR
ANTIGEN P53

(Homo sapiens) 		PF00870
(P53) 		5 PHE A 270
ILE A 195
PRO A 278
VAL A 122
VAL A 274
 None
 1.35A 1hrkB-2fejA:
undetectable		 1hrkB-2fejA:
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.
2hi4 CYTOCHROME P450 1A2

(Homo sapiens) 		PF00067
(p450) 		5 LEU A 450
PHE A 451
LEU A 382
ILE A 372
VAL A 227
 HEM  A 900 (-4.0A)
HEM  A 900 (-4.1A)
HEM  A 900 (-4.0A)
None
None
 1.21A 1hrkB-2hi4A:
undetectable		 1hrkB-2hi4A:
21.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2hmi FAB FRAGMENT OF
MONOCLONAL ANTIBODY
28

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		5 LEU D  69
MET D  85
ILE D  53
PRO D   9
VAL D  12
 None
 1.23A 1hrkB-2hmiD:
undetectable		 1hrkB-2hmiD:
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.
2j0j FOCAL ADHESION
KINASE 1

(Gallus gallus) 		PF00373
(FERM_M)
PF07714
(Pkinase_Tyr) 		5 LEU A 174
PHE A 231
LEU A 171
PRO A 249
VAL A 250
 None
 1.40A 1hrkB-2j0jA:
undetectable		 1hrkB-2j0jA:
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.
2o8e DNA MISMATCH REPAIR
PROTEIN MSH6

(Homo sapiens) 		PF00488
(MutS_V)
PF01624
(MutS_I)
PF05188
(MutS_II)
PF05190
(MutS_IV)
PF05192
(MutS_III) 		5 LEU B 655
PHE B 643
LEU B 638
ILE B 570
VAL B 688
 None
 1.20A 1hrkB-2o8eB:
undetectable		 1hrkB-2o8eB:
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.
2onk MOLYBDATE/TUNGSTATE
ABC TRANSPORTER,
ATP-BINDING PROTEIN

(Archaeoglobus
fulgidus) 		PF00005
(ABC_tran) 		5 LEU A 147
LEU A   3
MET A  22
VAL A  18
VAL A 183
 None
 1.25A 1hrkB-2onkA:
undetectable		 1hrkB-2onkA:
23.58
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.
2wm4 PUTATIVE CYTOCHROME
P450 124

(Mycobacterium
tuberculosis) 		PF00067
(p450) 		5 LEU A 264
PHE A 260
LEU A 238
ILE A 111
VAL A 133
 HEM  A 450 (-4.5A)
None
None
HEM  A 450 (-4.3A)
None
 1.44A 1hrkB-2wm4A:
undetectable		 1hrkB-2wm4A:
21.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2x66 PRNB

(Pseudomonas
fluorescens) 		PF08933
(DUF1864) 		5 LEU A 161
PHE A 171
LEU A 178
VAL A 305
VAL A 354
 None
 1.30A 1hrkB-2x66A:
undetectable		 1hrkB-2x66A:
22.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2xot AMPHOTERIN-INDUCED
PROTEIN 1

(Mus musculus) 		PF07679
(I-set)
PF13855
(LRR_8) 		5 LEU A 139
PHE A 130
LEU A 160
MET A 157
ILE A 146
 None
 1.43A 1hrkB-2xotA:
undetectable		 1hrkB-2xotA:
20.29
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.
2y35 LD22664P

(Drosophila
melanogaster) 		PF03159
(XRN_N) 		5 LEU A 251
LEU A  17
ILE A 210
VAL A 658
ARG A 742
 None
 1.24A 1hrkB-2y35A:
3.1		 1hrkB-2y35A:
16.42
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.
2y5w KINESIN HEAVY CHAIN

(Drosophila
melanogaster) 		PF00225
(Kinesin) 		5 LEU A 268
LEU A 290
ILE A  13
PRO A 170
VAL A 162
 None
 1.34A 1hrkB-2y5wA:
2.6		 1hrkB-2y5wA:
21.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2yab DEATH-ASSOCIATED
PROTEIN KINASE 2

(Mus musculus) 		PF00069
(Pkinase) 		5 LEU A 105
PHE A 296
LEU A 111
ILE A 145
TRP A 274
 None
 1.37A 1hrkB-2yabA:
undetectable		 1hrkB-2yabA:
21.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3a0g HEMOGLOBIN SUBUNIT
ALPHA

(Cavia porcellus) 		PF00042
(Globin) 		5 LEU A  29
PHE A  33
LEU A 101
ILE A  46
HIS A  87
 None
None
HEM  A 201 (-4.1A)
None
HEM  A 201 (-3.3A)
 1.31A 1hrkB-3a0gA:
undetectable		 1hrkB-3a0gA:
16.99
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.
3a79 TOLL-LIKE RECEPTOR
6, VARIABLE
LYMPHOCYTE RECEPTOR
B

(Eptatretus
burgeri;
Mus musculus) 		PF11921
(DUF3439)
PF13855
(LRR_8) 		5 LEU B 105
PHE B  96
LEU B 123
MET B 120
ILE B  88
 None
 1.38A 1hrkB-3a79B:
undetectable		 1hrkB-3a79B:
21.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3abb CYTOCHROME P450
HYDROXYLASE

(Streptomyces
avermitilis) 		PF00067
(p450) 		5 LEU A 284
LEU A 363
ILE A 318
PRO A 154
VAL A 153
 None
 1.30A 1hrkB-3abbA:
undetectable		 1hrkB-3abbA:
24.07
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.
3ap1 PROTEIN-TYROSINE
SULFOTRANSFERASE 2

(Homo sapiens) 		PF13469
(Sulfotransfer_3) 		5 LEU A 249
LEU A 253
VAL A 154
ARG A 153
VAL A  73
 None
 1.41A 1hrkB-3ap1A:
undetectable		 1hrkB-3ap1A:
21.81
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3aqi FERROCHELATASE

(Homo sapiens) 		PF00762
(Ferrochelatase) 		12 MET A  76
LEU A  92
PHE A  93
LEU A  98
MET A  99
ILE A 119
HIS A 263
PRO A 266
VAL A 269
ARG A 272
VAL A 305
TRP A 310
 CHD  A   1 ( 3.8A)
CHD  A   1 (-4.8A)
CHD  A   1 ( 4.7A)
CHD  A   1 (-4.3A)
CHD  A   2 (-4.0A)
None
CHD  A   1 (-4.3A)
CHD  A   2 ( 4.5A)
None
FES  A 501 (-4.1A)
CHD  A   1 ( 4.9A)
CHD  A   2 (-4.7A)
 0.54A 1hrkB-3aqiA:
60.9		 1hrkB-3aqiA:
99.72
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.
3bh0 DNAB-LIKE
REPLICATIVE HELICASE

(Bacillus phage
SPP1) 		PF03796
(DnaB_C) 		5 LEU A 380
LEU A 374
ILE A 314
VAL A 361
ARG A 364
 None
 1.27A 1hrkB-3bh0A:
2.9		 1hrkB-3bh0A:
23.27
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.
3fah ALDEHYDE
OXIDOREDUCTASE

(Desulfovibrio
gigas) 		PF00111
(Fer2)
PF01315
(Ald_Xan_dh_C)
PF01799
(Fer2_2)
PF02738
(Ald_Xan_dh_C2) 		5 LEU A 432
LEU A 284
MET A 212
ILE A 251
VAL A 300
 None
 1.35A 1hrkB-3fahA:
undetectable		 1hrkB-3fahA:
16.98
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.
3fhc NUCLEAR PORE COMPLEX
PROTEIN NUP214

(Homo sapiens) 		PF12894
(ANAPC4_WD40) 		5 LEU A 389
PHE A  19
LEU A 391
ILE A 310
ARG A 301
 None
 1.22A 1hrkB-3fhcA:
undetectable		 1hrkB-3fhcA:
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.
3fms TRANSCRIPTIONAL
REGULATOR, GNTR
FAMILY

(Thermotoga
maritima) 		PF00392
(GntR)
PF07729
(FCD) 		5 LEU A 193
LEU A 197
ILE A 101
VAL A 160
TRP A 154
 None
 1.21A 1hrkB-3fmsA:
undetectable		 1hrkB-3fmsA:
22.29
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.
3g68 PUTATIVE
PHOSPHOSUGAR
ISOMERASE

(Clostridioides
difficile) 		PF01380
(SIS) 		5 LEU A  55
LEU A 153
ILE A  61
VAL A 132
VAL A  28
 None
 1.36A 1hrkB-3g68A:
undetectable		 1hrkB-3g68A:
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.
3h77 PQS BIOSYNTHETIC
ENZYME

(Pseudomonas
aeruginosa) 		PF08541
(ACP_syn_III_C)
PF08545
(ACP_syn_III) 		5 MET A 225
LEU A 193
PHE A 218
HIS A 257
VAL A 282
 COW  A 350 (-3.7A)
CSJ  A 112 (-4.5A)
CSJ  A 112 ( 4.0A)
COW  A 350 (-4.2A)
None
 1.35A 1hrkB-3h77A:
2.6		 1hrkB-3h77A:
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.
3hj9 OXIDOREDUCTASE

(Cupriavidus
pinatubonensis) 		PF00881
(Nitroreductase) 		5 LEU A  64
LEU A  30
ILE A 210
PRO A 108
VAL A  95
 None
 1.44A 1hrkB-3hj9A:
undetectable		 1hrkB-3hj9A:
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.
3hjb GLUCOSE-6-PHOSPHATE
ISOMERASE

(Vibrio cholerae) 		PF00342
(PGI) 		5 LEU A 343
PHE A 346
MET A 165
ILE A 473
TRP A 275
 None
 1.44A 1hrkB-3hjbA:
2.2		 1hrkB-3hjbA:
20.95
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.
3hmj FATTY ACID SYNTHASE
SUBUNIT ALPHA

(Saccharomyces
cerevisiae) 		PF00109
(ketoacyl-synt)
PF01648
(ACPS)
PF02801
(Ketoacyl-synt_C) 		5 MET A1445
LEU A1009
LEU A1013
ILE A1004
VAL A1656
 None
 1.43A 1hrkB-3hmjA:
3.1		 1hrkB-3hmjA:
11.40
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.
3j8g GTPASE DER

(Escherichia
coli) 		PF01926
(MMR_HSR1)
PF14714
(KH_dom-like) 		5 ILE X 143
PRO X   3
VAL X   2
VAL X 158
TRP X 162
 None
 1.38A 1hrkB-3j8gX:
2.9		 1hrkB-3j8gX:
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.
3j8g GTPASE DER

(Escherichia
coli) 		PF01926
(MMR_HSR1)
PF14714
(KH_dom-like) 		5 LEU X   7
ILE X 143
PRO X   3
VAL X 158
TRP X 162
 None
 1.27A 1hrkB-3j8gX:
2.9		 1hrkB-3j8gX:
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.
3l6a EUKARYOTIC
TRANSLATION
INITIATION FACTOR 4
GAMMA 2

(Homo sapiens) 		PF02020
(W2)
PF02847
(MA3) 		5 LEU A  89
LEU A 128
ILE A  49
VAL A 162
VAL A 119
 None
None
None
MES  A 361 (-3.6A)
None
 1.13A 1hrkB-3l6aA:
undetectable		 1hrkB-3l6aA:
21.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3lly AGGLUTININ ALPHA
CHAIN

(Maclura
pomifera) 		PF01419
(Jacalin) 		5 LEU A  28
LEU A 124
ILE A  12
VAL A  72
VAL A  68
 None
 0.96A 1hrkB-3llyA:
undetectable		 1hrkB-3llyA:
15.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3m1m ORF904

(Sulfolobus
islandicus) 		PF09250
(Prim-Pol)
PF13010
(pRN1_helical) 		5 LEU A 228
PHE A 162
LEU A 110
PRO A 154
TRP A 246
 None
 1.10A 1hrkB-3m1mA:
undetectable		 1hrkB-3m1mA:
21.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3mc2 INHIBITOR OF
CARBONIC ANHYDRASE

(Mus musculus) 		PF00405
(Transferrin) 		5 MET A  26
LEU A 284
PHE A 285
VAL A  10
VAL A 251
 None
 1.08A 1hrkB-3mc2A:
undetectable		 1hrkB-3mc2A:
20.20
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.
3p8a UNCHARACTERIZED
PROTEIN

(Staphylococcus
aureus) 		PF13468
(Glyoxalase_3) 		5 LEU A 112
PHE A 212
LEU A 228
MET A 214
VAL A 196
 None
 1.31A 1hrkB-3p8aA:
undetectable		 1hrkB-3p8aA:
21.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3q41 GLUTAMATE [NMDA]
RECEPTOR SUBUNIT
ZETA-1

(Rattus
norvegicus) 		PF01094
(ANF_receptor) 		5 LEU A  33
PHE A  42
ILE A  90
VAL A 334
VAL A 288
 None
 1.38A 1hrkB-3q41A:
3.8		 1hrkB-3q41A:
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.
3sxm TRANSCRIPTIONAL
REGULATOR, GNTR
FAMILY

(Thermotoga
maritima) 		PF07729
(FCD) 		5 LEU A 193
LEU A 197
ILE A 101
VAL A 160
TRP A 154
 None
 1.24A 1hrkB-3sxmA:
undetectable		 1hrkB-3sxmA:
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.
3v4o MUCOSA-ASSOCIATED
LYMPHOID TISSUE
LYMPHOMA
TRANSLOCATION
PROTEIN 1

(Homo sapiens) 		PF00656
(Peptidase_C14) 		6 LEU A 515
PHE A 511
LEU A 369
ILE A 550
VAL A 380
VAL A 458
 None
 1.48A 1hrkB-3v4oA:
2.9		 1hrkB-3v4oA:
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.
3vfd SPASTIN

(Homo sapiens) 		PF00004
(AAA)
PF09336
(Vps4_C) 		5 LEU A 354
LEU A 378
MET A 484
ILE A 344
VAL A 443
 None
 1.37A 1hrkB-3vfdA:
2.4		 1hrkB-3vfdA:
23.61
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.
3zyi LEUCINE-RICH
REPEAT-CONTAINING
PROTEIN 4

(Homo sapiens) 		PF07679
(I-set)
PF13855
(LRR_8) 		5 LEU A 104
PHE A  95
LEU A 125
ILE A  87
VAL A 170
 None
 1.23A 1hrkB-3zyiA:
undetectable		 1hrkB-3zyiA:
20.79
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.
4a2i PUTATIVE RIBOSOME
BIOGENESIS GTPASE
RSGA

(Salmonella
enterica) 		PF03193
(RsgA_GTPase) 		5 LEU V 206
LEU V 235
ILE V 170
VAL V 272
VAL V 137
 None
 1.25A 1hrkB-4a2iV:
3.4		 1hrkB-4a2iV:
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.
4cr4 26S PROTEASE SUBUNIT
RPT4

(Saccharomyces
cerevisiae) 		PF00004
(AAA) 		5 MET L 312
LEU L 337
LEU L 343
ILE L 286
VAL L 196
 None
 1.27A 1hrkB-4cr4L:
2.1		 1hrkB-4cr4L:
21.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4fcx DNA REPAIR PROTEIN
RAD32

(Schizosaccharomyces
pombe) 		no annotation 5 LEU B 183
PHE B 158
LEU B 218
PRO B 271
VAL B 269
 None
 1.41A 1hrkB-4fcxB:
undetectable		 1hrkB-4fcxB:
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.
4gt6 CELL SURFACE PROTEIN

(Faecalibacterium
prausnitzii) 		PF13306
(LRR_5) 		5 PHE A 136
LEU A 165
ILE A  97
VAL A 191
VAL A 151
 None
None
None
EDO  A 908 (-4.5A)
None
 1.31A 1hrkB-4gt6A:
undetectable		 1hrkB-4gt6A:
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.
4h59 IRON-COMPOUND ABC
TRANSPORTER, IRON
COMPOUND-BINDING
PROTEIN

(Streptococcus
pneumoniae) 		PF01497
(Peripla_BP_2) 		5 LEU A 182
LEU A  72
ILE A 322
PRO A  76
VAL A  58
 None
 1.37A 1hrkB-4h59A:
undetectable		 1hrkB-4h59A:
22.62
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.
4hq1 PROBABLE RECEPTOR
PROTEIN KINASE TMK1

(Arabidopsis
thaliana) 		PF00560
(LRR_1)
PF08263
(LRRNT_2)
PF13855
(LRR_8) 		5 LEU A  84
LEU A  87
ILE A 100
PRO A  52
TRP A  55
 None
 1.23A 1hrkB-4hq1A:
undetectable		 1hrkB-4hq1A:
21.62
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.
4i1p MUCOSA-ASSOCIATED
LYMPHOID TISSUE
LYMPHOMA
TRANSLOCATION
PROTEIN 1

(Homo sapiens) 		PF00656
(Peptidase_C14) 		6 LEU A 515
PHE A 511
LEU A 369
ILE A 550
VAL A 380
VAL A 458
 None
 1.43A 1hrkB-4i1pA:
2.9		 1hrkB-4i1pA:
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.
4i9y E3 SUMO-PROTEIN
LIGASE RANBP2

(Homo sapiens) 		PF00160
(Pro_isomerase) 		5 MET A 100
PHE A   8
MET A  22
ILE A  67
PRO A   4
 None
 1.42A 1hrkB-4i9yA:
undetectable		 1hrkB-4i9yA:
17.75
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.
4mrp ABC TRANSPORTER
RELATED PROTEIN

(Novosphingobium
aromaticivorans) 		PF00005
(ABC_tran)
PF00664
(ABC_membrane) 		5 LEU A 520
LEU A 437
ILE A 392
PRO A 359
VAL A 356
 None
 1.36A 1hrkB-4mrpA:
undetectable		 1hrkB-4mrpA:
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.
4mxe N-ACETYLTRANSFERASE
ESCO1

(Homo sapiens) 		PF13880
(Acetyltransf_13) 		5 LEU A 791
LEU A 709
MET A 669
ILE A 766
VAL A 682
 None
 1.29A 1hrkB-4mxeA:
undetectable		 1hrkB-4mxeA:
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.
4o1s V-TYPE ATP SYNTHASE
ALPHA CHAIN

(Thermoplasma
volcanium) 		PF14890
(Intein_splicing) 		5 LEU A  97
LEU A 167
ILE A 137
PRO A  11
VAL A  12
 None
 1.28A 1hrkB-4o1sA:
undetectable		 1hrkB-4o1sA:
19.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4q7e RESPONSE REGULATOR
OF A TWO COMPONENT
REGULATORY SYSTEM

(Leptospira
biflexa) 		PF00072
(Response_reg) 		5 LEU A 111
PHE A 110
LEU A 107
ILE A 118
VAL A  29
 None
None
SO4  A 203 ( 4.5A)
None
None
 1.36A 1hrkB-4q7eA:
4.4		 1hrkB-4q7eA:
14.60
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.
4qjk PHOSPHOPANTETHEINYL
TRANSFERASE PPTT

(Mycobacterium
tuberculosis) 		PF01648
(ACPS) 		5 LEU A 210
LEU A 227
ILE A 178
PRO A  12
VAL A  15
 None
None
None
SO4  A 303 ( 4.9A)
None
 1.41A 1hrkB-4qjkA:
undetectable		 1hrkB-4qjkA:
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.
4u7l LEUCINE-RICH REPEATS
AND
IMMUNOGLOBULIN-LIKE
DOMAINS PROTEIN 1

(Homo sapiens) 		PF01463
(LRRCT)
PF13855
(LRR_8) 		5 LEU A 347
LEU A 368
ILE A 327
ARG A 418
VAL A 357
 None
 1.42A 1hrkB-4u7lA:
undetectable		 1hrkB-4u7lA:
23.94
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.
4u7l LEUCINE-RICH REPEATS
AND
IMMUNOGLOBULIN-LIKE
DOMAINS PROTEIN 1

(Homo sapiens) 		PF01463
(LRRCT)
PF13855
(LRR_8) 		5 LEU A 371
LEU A 392
MET A 389
ILE A 354
TRP A 410
 None
 1.33A 1hrkB-4u7lA:
undetectable		 1hrkB-4u7lA:
23.94
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.
4u7l LEUCINE-RICH REPEATS
AND
IMMUNOGLOBULIN-LIKE
DOMAINS PROTEIN 1

(Homo sapiens) 		PF01463
(LRRCT)
PF13855
(LRR_8) 		5 LEU A 371
LEU A 392
MET A 389
VAL A 381
TRP A 410
 None
 1.16A 1hrkB-4u7lA:
undetectable		 1hrkB-4u7lA:
23.94
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.
4u89 PHOSPHOPANTETHEINYL
TRANSFERASE PPTT

(Mycobacterium
tuberculosis) 		PF01648
(ACPS) 		5 LEU A 210
LEU A 227
ILE A 178
PRO A  12
VAL A  15
 None
 1.44A 1hrkB-4u89A:
undetectable		 1hrkB-4u89A:
20.98
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.
4wmj GLUCOSE-6-PHOSPHATE
ISOMERASE

(Colias
eurytheme) 		PF00342
(PGI) 		5 LEU A 348
PHE A 351
MET A 170
ILE A 480
TRP A 280
 None
 1.37A 1hrkB-4wmjA:
2.6		 1hrkB-4wmjA:
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.
4xh9 NEUROEPITHELIAL
CELL-TRANSFORMING
GENE 1 PROTEIN

(Homo sapiens) 		PF00169
(PH)
PF00621
(RhoGEF) 		5 MET A 182
LEU A 253
LEU A 232
ILE A 343
VAL A 349
 None
 1.35A 1hrkB-4xh9A:
undetectable		 1hrkB-4xh9A:
21.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4yke MRE11

(Chaetomium
thermophilum) 		PF00149
(Metallophos)
PF04152
(Mre11_DNA_bind) 		5 LEU A  76
LEU A 140
ILE A  40
PRO A  64
VAL A  20
 None
 1.39A 1hrkB-4ykeA:
undetectable		 1hrkB-4ykeA:
21.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4z0c TOLL-LIKE RECEPTOR
13

(Mus musculus) 		PF00560
(LRR_1)
PF13516
(LRR_6)
PF13855
(LRR_8) 		5 LEU A 156
PHE A 147
LEU A 176
ILE A 139
VAL A 166
 None
 1.29A 1hrkB-4z0cA:
undetectable		 1hrkB-4z0cA:
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.
4zrm UDP-GLUCOSE
4-EPIMERASE

(Thermotoga
maritima) 		PF01370
(Epimerase) 		5 MET A  58
LEU A 100
PHE A 112
LEU A   4
VAL A  17
 None
 1.43A 1hrkB-4zrmA:
3.2		 1hrkB-4zrmA:
23.28
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.
4zrq TRANSCOBALAMIN-2

(Homo sapiens) 		PF01122
(Cobalamin_bind)
PF14478
(DUF4430) 		5 LEU A 144
LEU A 183
PRO A 276
VAL A 277
VAL A  38
 None
 1.23A 1hrkB-4zrqA:
undetectable		 1hrkB-4zrqA:
21.73
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.
5cni METABOTROPIC
GLUTAMATE RECEPTOR 2

(Homo sapiens) 		PF01094
(ANF_receptor) 		5 LEU A  62
PHE A  38
LEU A  26
ILE A 378
VAL A 385
 None
 1.15A 1hrkB-5cniA:
3.9		 1hrkB-5cniA:
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.
5ddv 2-C-METHYL-D-ERYTHRI
TOL 4-PHOSPHATE
CYTIDYLYLTRANSFERASE

(Bacillus
subtilis) 		PF01128
(IspD) 		5 LEU A 169
PHE A 164
LEU A  91
PRO A   8
VAL A  52
 None
 1.17A 1hrkB-5ddvA:
undetectable		 1hrkB-5ddvA:
22.66
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.
5exp TRANSCRIPTIONAL
REGULATOR FLEQ

(Pseudomonas
aeruginosa) 		PF00158
(Sigma54_activat) 		5 LEU A 327
LEU A 331
ILE A 153
ARG A 340
VAL A 182
 None
None
None
None
EDO  A 404 (-4.6A)
 1.25A 1hrkB-5expA:
3.0		 1hrkB-5expA:
21.80
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.
5gsl 778AA LONG
HYPOTHETICAL
BETA-GALACTOSIDASE

(Pyrococcus
horikoshii) 		PF02449
(Glyco_hydro_42) 		5 LEU A 472
PHE A 473
LEU A 478
VAL A 487
VAL A 491
 None
 1.26A 1hrkB-5gslA:
2.9		 1hrkB-5gslA:
19.68
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.
5gzy (R)-2-HALOACID
DEHALOGENASE

(Pseudomonas
putida) 		PF10778
(DehI) 		5 PHE A 295
LEU A 216
MET A 209
ILE A 227
VAL A 177
 None
 1.15A 1hrkB-5gzyA:
undetectable		 1hrkB-5gzyA:
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.
5hz1 PROBABLE LRR
RECEPTOR-LIKE
SERINE/THREONINE-PRO
TEIN KINASE
AT4G26540

(Arabidopsis
thaliana) 		PF13855
(LRR_8) 		5 LEU B 119
PHE B 116
LEU B 140
ILE B  77
PRO B 134
 None
 1.35A 1hrkB-5hz1B:
undetectable		 1hrkB-5hz1B:
21.51
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.
5khl HEMIN ABC
TRANSPORTER,
PERIPLASMIC
HEMIN-BINDING
PROTEIN HUTB

(Vibrio cholerae) 		PF01497
(Peripla_BP_2) 		5 MET B  88
LEU B  82
LEU B  74
ILE B 126
PRO B  61
 None
 1.41A 1hrkB-5khlB:
undetectable		 1hrkB-5khlB:
20.49
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.
5kzn METABOTROPIC
GLUTAMATE RECEPTOR 2

(Homo sapiens) 		PF01094
(ANF_receptor)
PF07562
(NCD3G) 		5 LEU A  62
PHE A  38
LEU A  26
ILE A 378
VAL A 385
 None
 1.16A 1hrkB-5kznA:
4.6		 1hrkB-5kznA:
19.26
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.
5lq3 CMEB

(Campylobacter
jejuni) 		PF00873
(ACR_tran) 		5 LEU A  28
PHE A 382
LEU A 379
ILE A  33
VAL A 343
 None
 1.25A 1hrkB-5lq3A:
undetectable		 1hrkB-5lq3A:
15.93
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.
5m8j DIVALENT METAL
CATION TRANSPORTER
MNTH

(Eremococcus
coleocola) 		PF01566
(Nramp) 		5 MET A 491
LEU A 412
PHE A 409
LEU A 117
ILE A 464
 None
 1.36A 1hrkB-5m8jA:
undetectable		 1hrkB-5m8jA:
20.70
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.
5mqs BETA-L-ARABINOBIOSID
ASE

(Bacteroides
thetaiotaomicron) 		PF13088
(BNR_2) 		5 MET A 693
LEU A 680
LEU A 723
ILE A 995
VAL A 765
 None
 1.44A 1hrkB-5mqsA:
undetectable		 1hrkB-5mqsA:
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.
5nug CYTOPLASMIC DYNEIN 1
HEAVY CHAIN 1

(Homo sapiens) 		PF03028
(Dynein_heavy)
PF07728
(AAA_5)
PF08393
(DHC_N2)
PF12774
(AAA_6)
PF12775
(AAA_7)
PF12777
(MT)
PF12780
(AAA_8)
PF12781
(AAA_9) 		5 LEU A1547
PHE A1551
LEU A1638
ILE A1571
ARG A1623
 None
 1.12A 1hrkB-5nugA:
undetectable		 1hrkB-5nugA:
5.86
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.
5ovu BETA-PROTEOBACTERIA
PROTEASOME HOMOLOGUE

(Cupriavidus
metallidurans) 		no annotation 5 LEU A  87
LEU A  60
MET A  57
VAL A  40
VAL A 121
 None
 1.10A 1hrkB-5ovuA:
undetectable		 1hrkB-5ovuA:
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.
5sva MEDIATOR OF RNA
POLYMERASE II
TRANSCRIPTION
SUBUNIT 7
MEDIATOR OF RNA
POLYMERASE II
TRANSCRIPTION
SUBUNIT 31

(Saccharomyces
cerevisiae;
Saccharomyces
cerevisiae) 		PF05983
(Med7)
PF05669
(Med31) 		5 LEU X  85
LEU X  58
ILE X  36
PRO U  17
VAL U  20
 None
 1.34A 1hrkB-5svaX:
undetectable		 1hrkB-5svaX:
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.
5wid -

(-) 		no annotation 5 MET A 109
LEU A  74
PHE A  69
ILE A   4
PRO A  97
 None
 1.44A 1hrkB-5widA:
4.0		 1hrkB-5widA:
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.
5x0y TRANSCRIPTION
REGULATORY PROTEIN
SNF2

(Saccharomyces
cerevisiae) 		PF00176
(SNF2_N)
PF00271
(Helicase_C)
PF14619
(SnAC) 		5 LEU O1211
PHE O1181
LEU O1091
ARG O1304
VAL O1106
 None
 1.18A 1hrkB-5x0yO:
2.6		 1hrkB-5x0yO:
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.
5x3t ANTITOXIN VAPB26
RIBONUCLEASE VAPC26

(Mycobacterium
tuberculosis;
Mycobacterium
tuberculosis) 		PF01402
(RHH_1)
PF01850
(PIN) 		5 LEU A  65
PHE A  68
LEU B  46
ILE B  95
VAL B  59
 None
 1.37A 1hrkB-5x3tA:
undetectable		 1hrkB-5x3tA:
13.74
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.
5xk2 DIACYLGLYCEROL
LIPASE

(Aspergillus
oryzae) 		no annotation 5 LEU A 211
PHE A 103
LEU A 213
MET A 216
ILE A  94
 None
 1.39A 1hrkB-5xk2A:
undetectable		 1hrkB-5xk2A:
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.
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron) 		no annotation 5 LEU A 590
PHE A 591
LEU A 410
ILE A 461
VAL A 398
 None
 1.42A 1hrkB-5xxoA:
3.1		 1hrkB-5xxoA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5z24 PILUS ASSEMBLY
PROTEIN

(Lactobacillus
rhamnosus) 		no annotation 5 LEU A 443
PHE A 363
LEU A 421
PRO A 406
VAL A 397
 None
 1.29A 1hrkB-5z24A:
undetectable		 1hrkB-5z24A:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6dxp -

(-) 		no annotation 5 LEU A 104
PHE A 108
LEU A   7
VAL A   4
VAL A 168
 None
 1.35A 1hrkB-6dxpA:
3.5		 1hrkB-6dxpA:
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.
6gi2 FERRIC ENTEROBACTIN
ESTERASE

(Pseudomonas
aeruginosa) 		no annotation 5 LEU A  27
LEU A 131
ARG A 170
VAL A  84
TRP A  56
 None
 1.23A 1hrkB-6gi2A:
undetectable		 1hrkB-6gi2A:
undetectable