SIMILAR PATTERNS OF AMINO ACIDS FOR 2AZQ_A_PCFA954_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.
1e0r THERMOSOME

(Thermoplasma
acidophilum) 		PF00118
(Cpn60_TCP1) 		5 LEU B 240
GLU B 245
ALA B 299
TYR B 302
GLU B 271
 None
 1.42A 2azqA-1e0rB:
undetectable		 2azqA-1e0rB:
19.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1f0x D-LACTATE
DEHYDROGENASE

(Escherichia
coli) 		PF01565
(FAD_binding_4)
PF09330
(Lact-deh-memb) 		5 THR A 269
ALA A 118
TYR A 119
LEU A 107
LEU A 175
 None
 1.25A 2azqA-1f0xA:
0.2		 2azqA-1f0xA:
21.20
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.
1gsq GLUTATHIONE
S-TRANSFERASE

(Todarodes
pacificus) 		PF02798
(GST_N)
PF14497
(GST_C_3) 		5 THR A  91
HIS A  69
ALA A  71
LEU A  76
GLU A  26
 None
 1.45A 2azqA-1gsqA:
0.5		 2azqA-1gsqA:
20.28
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.
1hko CYTOCHROME B5

(Bos taurus) 		PF00173
(Cyt-b5) 		5 THR A  59
LEU A  29
GLU A  82
HIS A  84
LEU A  13
 None
HEM  A 105 (-3.2A)
None
None
None
 1.45A 2azqA-1hkoA:
undetectable		 2azqA-1hkoA:
15.52
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.
1jql DNA POLYMERASE III,
DELTA SUBUNIT

(Escherichia
coli) 		PF06144
(DNA_pol3_delta) 		5 THR B  79
LEU B  81
ALA B  37
LEU B  13
LEU B  30
 None
 1.37A 2azqA-1jqlB:
undetectable		 2azqA-1jqlB:
19.87
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.
1jr7 HYPOTHETICAL 37.4
KDA PROTEIN IN
ILEY-GABD INTERGENIC
REGION

(Escherichia
coli) 		PF08943
(CsiD) 		5 LEU A 193
HIS A 205
ALA A 208
GLU A 255
LEU A 259
 None
 1.42A 2azqA-1jr7A:
0.0		 2azqA-1jr7A:
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.
1ko7 HPR
KINASE/PHOSPHATASE

(Staphylococcus
xylosus) 		PF02603
(Hpr_kinase_N)
PF07475
(Hpr_kinase_C) 		5 THR A   4
LEU A  22
GLU A 104
HIS A 103
ALA A 100
 None
 1.36A 2azqA-1ko7A:
0.0		 2azqA-1ko7A:
23.10
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.
1ko7 HPR
KINASE/PHOSPHATASE

(Staphylococcus
xylosus) 		PF02603
(Hpr_kinase_N)
PF07475
(Hpr_kinase_C) 		5 THR A   4
LEU A  22
GLU A 104
HIS A 103
GLU A  98
 None
 1.03A 2azqA-1ko7A:
0.0		 2azqA-1ko7A:
23.10
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.
1lqa TAS PROTEIN

(Escherichia
coli) 		PF00248
(Aldo_ket_red) 		5 LEU A 118
GLU A  51
HIS A 132
LEU A 128
LEU A 105
 None
None
NDP  A1400 (-4.4A)
None
None
 1.32A 2azqA-1lqaA:
undetectable		 2azqA-1lqaA:
20.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1nw1 CHOLINE KINASE (49.2
KD)

(Caenorhabditis
elegans) 		PF01633
(Choline_kinase) 		5 LEU A  36
GLU A  54
HIS A  57
ALA A  56
LEU A 110
 None
 1.34A 2azqA-1nw1A:
0.0		 2azqA-1nw1A:
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.
1o5h FORMIMINOTETRAHYDROF
OLATE CYCLODEAMINASE

(Thermotoga
maritima) 		PF04961
(FTCD_C) 		5 LEU A  73
GLU A  40
ALA A  65
GLU A  58
LEU A 126
 None
 1.42A 2azqA-1o5hA:
1.1		 2azqA-1o5hA:
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.
1o7f CAMP-DEPENDENT RAP1
GUANINE-NUCLEOTIDE
EXCHANGE FACTOR

(Mus musculus) 		PF00027
(cNMP_binding)
PF00610
(DEP) 		5 THR A 111
LEU A 107
ALA A 159
TYR A 162
LEU A 158
 None
 1.37A 2azqA-1o7fA:
undetectable		 2azqA-1o7fA:
22.08
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.
1tuo PUTATIVE
PHOSPHOMANNOMUTASE

(Thermus
thermophilus) 		PF00408
(PGM_PMM_IV)
PF02878
(PGM_PMM_I)
PF02879
(PGM_PMM_II)
PF02880
(PGM_PMM_III) 		5 THR A  31
LEU A  32
HIS A  42
ALA A  38
LEU A  77
 None
 1.27A 2azqA-1tuoA:
undetectable		 2azqA-1tuoA:
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.
1wer P120GAP

(Homo sapiens) 		PF00616
(RasGAP) 		5 LEU A 752
HIS A 736
ALA A 740
LEU A1012
LEU A 729
 None
 1.47A 2azqA-1werA:
undetectable		 2azqA-1werA:
24.12
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.
1wg8 PREDICTED
S-ADENOSYLMETHIONINE
-DEPENDENT
METHYLTRANSFERASE

(Thermus
thermophilus) 		PF01795
(Methyltransf_5) 		5 GLU A 151
ALA A 200
LEU A 201
GLU A 208
LEU A 209
 None
 1.14A 2azqA-1wg8A:
undetectable		 2azqA-1wg8A:
23.39
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.
1x9j PROBABLE BUTYRATE
KINASE 2

(Thermotoga
maritima) 		PF00871
(Acetate_kinase) 		5 LEU A  77
HIS A 114
ALA A 110
GLU A  51
LEU A  47
 None
 1.38A 2azqA-1x9jA:
undetectable		 2azqA-1x9jA:
22.31
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.
1xls ORPHAN NUCLEAR
RECEPTOR NR1I3

(Mus musculus) 		PF00104
(Hormone_recep) 		5 LEU E 253
GLU E 237
HIS E 241
ALA E 239
LEU E 151
 None
None
None
TCD  E 805 ( 4.0A)
None
 1.22A 2azqA-1xlsE:
undetectable		 2azqA-1xlsE:
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.
1yll CONSERVED
HYPOTHETICAL PROTEIN

(Pseudomonas
aeruginosa) 		PF05962
(HutD) 		5 THR A 139
LEU A 193
ALA A  28
LEU A   7
GLU A  25
 None
 1.46A 2azqA-1yllA:
undetectable		 2azqA-1yllA:
23.56
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2azq CATECHOL
1,2-DIOXYGENASE

(Pseudomonas
putida) 		PF00775
(Dioxygenase_C)
PF04444
(Dioxygenase_N) 		9 THR A  40
LEU A  43
GLU A  53
HIS A  56
ALA A  57
TYR A  60
LEU A  61
GLU A 206
LEU A 210
 PCF  A 954 ( 4.1A)
PCF  A 954 ( 4.9A)
PCF  A 954 (-4.5A)
PCF  A 954 ( 4.5A)
PCF  A 954 (-3.5A)
PCF  A 954 (-4.1A)
None
PCF  A 954 ( 4.6A)
PCF  A 954 (-4.8A)
 0.00A 2azqA-2azqA:
45.6		 2azqA-2azqA:
100.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2b39 C3

(Bos taurus) 		PF00207
(A2M)
PF01759
(NTR)
PF01821
(ANATO)
PF01835
(A2M_N)
PF07677
(A2M_recep)
PF07678
(A2M_comp)
PF07703
(A2M_N_2)
PF10569
(Thiol-ester_cl) 		5 LEU A1002
HIS A1025
ALA A1023
TYR A1026
LEU A1027
 None
 1.34A 2azqA-2b39A:
2.9		 2azqA-2b39A:
11.06
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.
2c5a GDP-MANNOSE-3',
5'-EPIMERASE

(Arabidopsis
thaliana) 		PF01370
(Epimerase) 		5 THR A 259
LEU A 258
GLU A 182
ALA A 141
LEU A  98
 None
None
None
NAD  A1378 (-3.6A)
NAD  A1378 (-4.3A)
 1.24A 2azqA-2c5aA:
undetectable		 2azqA-2c5aA:
20.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2clb DPS-LIKE PROTEIN

(Sulfolobus
solfataricus) 		PF00210
(Ferritin) 		5 LEU A  26
GLU A 133
ALA A  33
GLU A 156
LEU A 153
 None
None
None
ZN  A1175 ( 2.3A)
None
 1.34A 2azqA-2clbA:
undetectable		 2azqA-2clbA:
20.99
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.
2drw D-AMINO ACID AMIDASE

(Ochrobactrum
anthropi) 		PF00144
(Beta-lactamase) 		5 THR A 190
LEU A 236
GLU A 114
ALA A 242
LEU A 308
 None
 1.35A 2azqA-2drwA:
undetectable		 2azqA-2drwA:
22.87
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.
2h6c CHLOROPHENOL
REDUCTION GENE K

(Desulfitobacterium
dehalogenans) 		PF13545
(HTH_Crp_2) 		5 THR A 104
LEU A  56
ALA A  96
TYR A  95
GLU A  72
 None
 1.42A 2azqA-2h6cA:
undetectable		 2azqA-2h6cA:
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.
2hig 6-PHOSPHO-1-FRUCTOKI
NASE

(Trypanosoma
brucei) 		PF00365
(PFK) 		5 THR A 227
LEU A 232
ALA A 416
LEU A 398
GLU A 405
 None
 1.30A 2azqA-2higA:
undetectable		 2azqA-2higA:
21.14
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.
2iyf OLEANDOMYCIN
GLYCOSYLTRANSFERASE

(Streptomyces
antibioticus) 		PF00201
(UDPGT) 		5 THR A 359
LEU A 363
HIS A 305
ALA A 323
LEU A 196
 None
None
UDP  A1401 (-4.0A)
None
None
 1.20A 2azqA-2iyfA:
undetectable		 2azqA-2iyfA:
23.73
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.
2j3e T7I23.11 PROTEIN

(Arabidopsis
thaliana) 		PF04548
(AIG1) 		5 LEU A  56
ALA A 207
TYR A 206
LEU A 223
LEU A 156
 None
 1.30A 2azqA-2j3eA:
undetectable		 2azqA-2j3eA:
21.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2no5 (S)-2-HALOACID
DEHALOGENASE IVA

(Burkholderia
cepacia) 		PF13419
(HAD_2) 		5 LEU A 139
ALA A 101
TYR A  98
LEU A 216
LEU A  95
 None
None
SO4  A1011 ( 4.9A)
SO4  A1006 ( 3.4A)
None
 1.39A 2azqA-2no5A:
undetectable		 2azqA-2no5A:
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.
2o1e YCDH

(Bacillus
subtilis) 		PF01297
(ZnuA) 		5 THR A 190
ALA A 199
TYR A 202
LEU A 204
LEU A 135
 None
 1.34A 2azqA-2o1eA:
undetectable		 2azqA-2o1eA:
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.
2pce PUTATIVE MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME

(Roseovarius
nubinhibens) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 THR A 125
LEU A 282
ALA A 309
LEU A 356
GLU A  49
 None
 1.37A 2azqA-2pceA:
undetectable		 2azqA-2pceA:
24.57
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.
2pl2 HYPOTHETICAL
CONSERVED PROTEIN
TTC0263

(Thermus
thermophilus) 		PF13429
(TPR_15)
PF14559
(TPR_19) 		5 LEU A 211
GLU A 183
ALA A 194
GLU A 162
LEU A 165
 None
 1.39A 2azqA-2pl2A:
undetectable		 2azqA-2pl2A:
21.29
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.
2ra5 PUTATIVE
TRANSCRIPTIONAL
REGULATOR

(Streptomyces
coelicolor) 		PF00392
(GntR)
PF07702
(UTRA) 		5 HIS A 228
ALA A 146
TYR A 147
LEU A 200
GLU A 135
 SRT  A 247 ( 4.8A)
None
None
None
None
 1.45A 2azqA-2ra5A:
undetectable		 2azqA-2ra5A:
22.67
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.
2vsa MOSQUITOCIDAL TOXIN

(Lysinibacillus
sphaericus) 		PF05588
(Botulinum_HA-17)
PF14200
(RicinB_lectin_2) 		5 THR A 848
LEU A 833
GLU A 813
ALA A 826
TYR A 809
 None
 1.44A 2azqA-2vsaA:
undetectable		 2azqA-2vsaA:
14.57
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.
2w6l COBE

(Pseudomonas
aeruginosa) 		PF01890
(CbiG_C) 		5 THR A  31
LEU A  32
ALA A 104
GLU A 109
LEU A 135
 None
 1.41A 2azqA-2w6lA:
undetectable		 2azqA-2w6lA:
21.36
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.
2ww8 CELL WALL SURFACE
ANCHOR FAMILY
PROTEIN

(Streptococcus
pneumoniae) 		PF13519
(VWA_2) 		5 THR A 386
ALA A 362
LEU A 363
GLU A 368
LEU A 322
 None
 1.04A 2azqA-2ww8A:
4.3		 2azqA-2ww8A:
17.47
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.
2xpi ANAPHASE-PROMOTING
COMPLEX SUBUNIT CUT9

(Schizosaccharomyces
pombe) 		PF12895
(ANAPC3)
PF13181
(TPR_8)
PF13424
(TPR_12) 		5 LEU A 279
GLU A 287
ALA A 291
TYR A 294
LEU A 295
 None
 1.24A 2azqA-2xpiA:
undetectable		 2azqA-2xpiA:
20.66
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.
2yyl 4-HYDROXYPHENYLACETA
TE-3-HYDROXYLASE

(Thermus
thermophilus) 		PF03241
(HpaB)
PF11794
(HpaB_N) 		5 LEU A 105
GLU A 191
ALA A 189
LEU A 188
LEU A 220
 None
 1.41A 2azqA-2yylA:
1.0		 2azqA-2yylA:
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.
2z36 CYTOCHROME P450 TYPE
COMPACTIN
3'',4''-HYDROXYLASE

(Nonomuraea
recticatena) 		PF00067
(p450) 		5 LEU A 382
GLU A 402
HIS A 401
GLU A 248
LEU A 153
 None
 1.27A 2azqA-2z36A:
0.0		 2azqA-2z36A:
24.32
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.
3bz5 INTERNALIN-J

(Listeria
monocytogenes) 		PF12799
(LRR_4) 		5 THR A 379
LEU A 376
HIS A 311
ALA A 333
LEU A 328
 None
 1.45A 2azqA-3bz5A:
undetectable		 2azqA-3bz5A:
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.
3dwb ENDOTHELIN-CONVERTIN
G ENZYME 1

(Homo sapiens) 		PF01431
(Peptidase_M13)
PF05649
(Peptidase_M13_N) 		5 THR A 385
LEU A 389
GLU A 311
ALA A 313
LEU A 278
 None
 1.21A 2azqA-3dwbA:
undetectable		 2azqA-3dwbA:
18.37
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.
3e6c CYCLIC
NUCLEOTIDE-BINDING
PROTEIN

(Desulfitobacterium
hafniense) 		PF00027
(cNMP_binding)
PF13545
(HTH_Crp_2) 		5 THR C 104
LEU C  56
ALA C  96
TYR C  95
GLU C  72
 None
 1.46A 2azqA-3e6cC:
undetectable		 2azqA-3e6cC:
20.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3emv URIDINE
PHOSPHORYLASE,
PUTATIVE

(Plasmodium
vivax) 		PF01048
(PNP_UDP_1) 		5 LEU A 222
GLU A 228
LEU A  21
GLU A 236
LEU A 146
 None
 1.35A 2azqA-3emvA:
undetectable		 2azqA-3emvA:
18.67
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.
3fs2 2-DEHYDRO-3-DEOXYPHO
SPHOOCTONATE
ALDOLASE

(Brucella
melitensis) 		PF00793
(DAHP_synth_1) 		5 THR A  96
LEU A  95
ALA A 130
LEU A 126
LEU A 154
 None
 1.41A 2azqA-3fs2A:
undetectable		 2azqA-3fs2A:
23.89
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.
3fvr ACETYL XYLAN
ESTERASE

(Bacillus
pumilus) 		PF05448
(AXE1) 		5 LEU A 161
HIS A  82
ALA A  84
TYR A 110
LEU A 316
 None
 1.39A 2azqA-3fvrA:
undetectable		 2azqA-3fvrA:
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.
3gq2 GENERAL VESICULAR
TRANSPORT FACTOR
P115

(Bos taurus) 		PF04869
(Uso1_p115_head) 		5 THR A 194
LEU A 193
GLU A 207
ALA A 209
LEU A 213
 None
 1.41A 2azqA-3gq2A:
undetectable		 2azqA-3gq2A:
19.87
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.
3jd5 28S RIBOSOMAL
PROTEIN S27,
MITOCHONDRIAL

(Bos taurus) 		PF00333
(Ribosomal_S5)
PF03719
(Ribosomal_S5_C) 		5 THR e 111
GLU e  84
HIS e  87
ALA e  88
LEU e  92
 None
 1.47A 2azqA-3jd5e:
undetectable		 2azqA-3jd5e:
21.83
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.
3l3p IPAH9.8

(Shigella
flexneri) 		PF14496
(NEL) 		5 THR A 366
LEU A 369
TYR A 523
LEU A 526
GLU A 519
 None
 1.19A 2azqA-3l3pA:
undetectable		 2azqA-3l3pA:
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.
3msv NUCLEAR IMPORT
ADAPTOR, NRO1

(Schizosaccharomyces
pombe) 		PF12753
(Nro1) 		5 LEU A 213
ALA A 175
LEU A 125
GLU A 145
LEU A 183
 None
 1.47A 2azqA-3msvA:
1.5		 2azqA-3msvA:
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.
3ng0 GLUTAMINE SYNTHETASE

(Synechocystis
sp. PCC 6803) 		PF00120
(Gln-synt_C)
PF03951
(Gln-synt_N) 		5 LEU A 432
GLU A 426
ALA A 424
GLU A 419
LEU A 451
 None
 1.25A 2azqA-3ng0A:
undetectable		 2azqA-3ng0A:
22.17
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.
3o8j 2-METHYLCITRATE
SYNTHASE

(Salmonella
enterica) 		PF00285
(Citrate_synt) 		5 LEU A  42
HIS A  55
ALA A  53
GLU A  60
LEU A  70
 None
 1.12A 2azqA-3o8jA:
undetectable		 2azqA-3o8jA:
22.06
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.
3og9 PROTEIN YAHD A
COPPER INDUCIBLE
HYDROLASE

(Lactococcus
lactis) 		PF01738
(DLH) 		5 LEU A  29
GLU A 194
ALA A 198
LEU A 202
LEU A 151
 None
 1.37A 2azqA-3og9A:
undetectable		 2azqA-3og9A:
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.
3osr MALTOSE-BINDING
PERIPLASMIC
PROTEIN,GREEN
FLUORESCENT PROTEIN

(Escherichia
coli;
Aequorea
victoria) 		PF01353
(GFP)
PF01547
(SBP_bac_1) 		5 THR A  93
LEU A  89
GLU A 309
LEU A 299
GLU A 291
 None
 1.47A 2azqA-3osrA:
undetectable		 2azqA-3osrA:
19.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3sqw ATP-DEPENDENT RNA
HELICASE MSS116,
MITOCHONDRIAL

(Saccharomyces
cerevisiae) 		PF00270
(DEAD)
PF00271
(Helicase_C) 		5 LEU A 246
ALA A 193
LEU A 194
GLU A 199
LEU A 163
 None
None
None
ANP  A 800 ( 4.9A)
None
 1.30A 2azqA-3sqwA:
undetectable		 2azqA-3sqwA:
18.39
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.
3tw0 CELL WALL SURFACE
ANCHOR FAMILY
PROTEIN

(Streptococcus
agalactiae) 		PF00092
(VWA) 		5 THR A 383
ALA A 359
LEU A 360
GLU A 365
LEU A 319
 None
 0.99A 2azqA-3tw0A:
undetectable		 2azqA-3tw0A:
22.77
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.
3txa CELL WALL SURFACE
ANCHOR FAMILY
PROTEIN

(Streptococcus
agalactiae) 		PF00092
(VWA) 		5 THR A 383
ALA A 359
LEU A 360
GLU A 365
LEU A 319
 None
 1.13A 2azqA-3txaA:
undetectable		 2azqA-3txaA:
18.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4b94 DUAL SPECIFICITY
PROTEIN KINASE TTK

(Homo sapiens) 		no annotation 5 LEU A 165
ALA A 183
LEU A 195
GLU A 178
LEU A 177
 None
 1.43A 2azqA-4b94A:
undetectable		 2azqA-4b94A:
22.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4dws CHI2

(Yersinia
entomophaga) 		PF00704
(Glyco_hydro_18) 		5 GLU A 458
ALA A 460
TYR A 463
LEU A 403
GLU A 467
 None
None
MLY  A 400 ( 4.9A)
MLY  A 400 ( 4.0A)
None
 1.45A 2azqA-4dwsA:
undetectable		 2azqA-4dwsA:
21.41
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.
4e16 PRECORRIN-4
C(11)-METHYLTRANSFER
ASE

(Clostridioides
difficile) 		PF00590
(TP_methylase) 		5 THR A 186
LEU A 206
GLU A 179
ALA A 155
TYR A 154
 None
 1.31A 2azqA-4e16A:
undetectable		 2azqA-4e16A:
20.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4m0k ADENINE
PHOSPHORIBOSYLTRANSF
ERASE

(Rhodothermus
marinus) 		PF00156
(Pribosyltran) 		5 LEU A 177
GLU A   7
ALA A  12
GLU A  37
LEU A  41
 None
 1.42A 2azqA-4m0kA:
undetectable		 2azqA-4m0kA:
23.47
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.
4nae HEPTAPRENYLGLYCERYL
PHOSPHATE SYNTHASE

(Geobacillus
kaustophilus) 		PF01884
(PcrB) 		5 LEU A 160
HIS A 151
ALA A 149
TYR A 153
LEU A 155
 None
 1.43A 2azqA-4naeA:
undetectable		 2azqA-4naeA:
23.69
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.
4nre ARACHIDONATE
15-LIPOXYGENASE B

(Homo sapiens) 		PF00305
(Lipoxygenase)
PF01477
(PLAT) 		5 THR A 409
LEU A 410
HIS A 394
LEU A 402
LEU A 142
 None
 1.19A 2azqA-4nreA:
undetectable		 2azqA-4nreA:
18.71
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.
4ons CATENIN ALPHA-2

(Mus musculus) 		PF01044
(Vinculin) 		5 THR A  21
ALA A  92
LEU A  89
GLU A  76
LEU A  72
 None
 1.46A 2azqA-4onsA:
1.7		 2azqA-4onsA:
21.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4q66 PROTEIN BCH1

(Saccharomyces
cerevisiae) 		no annotation 5 LEU K 351
HIS K 299
ALA K 302
LEU K 292
GLU K 297
 None
 1.28A 2azqA-4q66K:
0.0		 2azqA-4q66K:
17.32
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.
4r33 NOSL

(Streptomyces
actuosus) 		PF06968
(BATS) 		5 THR A 312
GLU A  73
TYR A 302
LEU A 305
GLU A 324
 None
 1.26A 2azqA-4r33A:
undetectable		 2azqA-4r33A:
23.33
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.
4tz0 ATP-DEPENDENT RNA
HELICASE MSS116,
MITOCHONDRIAL

(Saccharomyces
cerevisiae) 		PF00270
(DEAD)
PF00271
(Helicase_C) 		5 LEU A 246
ALA A 193
LEU A 194
GLU A 199
LEU A 163
 None
None
None
GDP  A 601 ( 4.2A)
None
 1.32A 2azqA-4tz0A:
undetectable		 2azqA-4tz0A:
21.24
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.
4zxw C-DOMAIN TYPE II
PEPTIDE SYNTHETASE

(Streptomyces
globisporus) 		PF00668
(Condensation) 		5 LEU A  64
ALA A 152
LEU A 126
GLU A 122
LEU A 118
 None
None
None
SUC  A 502 ( 4.8A)
None
 1.33A 2azqA-4zxwA:
undetectable		 2azqA-4zxwA:
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.
4zxz LEVOGLUCOSAN KINASE

(Lipomyces
starkeyi) 		PF03702
(AnmK) 		5 THR A 205
LEU A 204
HIS A 167
ALA A 168
LEU A 369
 None
 1.24A 2azqA-4zxzA:
undetectable		 2azqA-4zxzA:
22.52
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.
5c6m DEOXYRIBOSE-PHOSPHAT
E ALDOLASE

(Shewanella
halifaxensis) 		PF01791
(DeoC) 		5 LEU A  14
ALA A 216
LEU A 220
GLU A 182
LEU A 178
 None
 1.38A 2azqA-5c6mA:
undetectable		 2azqA-5c6mA:
22.33
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.
5c6m DEOXYRIBOSE-PHOSPHAT
E ALDOLASE

(Shewanella
halifaxensis) 		PF01791
(DeoC) 		5 THR A 226
LEU A  14
ALA A 216
GLU A 182
LEU A 178
 None
 1.45A 2azqA-5c6mA:
undetectable		 2azqA-5c6mA:
22.33
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.
5c98 AGAP007691-PB

(Anopheles
gambiae) 		PF00079
(Serpin) 		5 LEU A 259
ALA A 359
LEU A 287
GLU A 202
LEU A 203
 None
 1.20A 2azqA-5c98A:
undetectable		 2azqA-5c98A:
21.52
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.
5cwa ANTHRANILATE
SYNTHASE COMPONENT 1

(Mycobacterium
tuberculosis) 		PF00425
(Chorismate_bind)
PF04715
(Anth_synt_I_N) 		5 LEU A 358
GLU A 307
HIS A 388
ALA A 323
GLU A 488
 None
0GA  A 604 ( 4.5A)
0GA  A 604 ( 4.3A)
None
0GA  A 604 ( 4.9A)
 1.40A 2azqA-5cwaA:
undetectable		 2azqA-5cwaA:
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.
5czz CRISPR-ASSOCIATED
ENDONUCLEASE CAS9

(Staphylococcus
aureus) 		PF13395
(HNH_4)
PF16592
(Cas9_REC) 		5 LEU A  70
HIS A 111
ALA A 113
GLU A 179
LEU A 183
 None
A  B  50 ( 3.9A)
None
None
None
 1.42A 2azqA-5czzA:
undetectable		 2azqA-5czzA:
14.27
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.
5czz CRISPR-ASSOCIATED
ENDONUCLEASE CAS9

(Staphylococcus
aureus) 		PF13395
(HNH_4)
PF16592
(Cas9_REC) 		5 LEU A1035
HIS A 701
ALA A 702
LEU A 706
GLU A 477
 None
 1.10A 2azqA-5czzA:
undetectable		 2azqA-5czzA:
14.27
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.
5d79 BERBERINE BRIDGE
ENZYME-LIKE PROTEIN

(Arabidopsis
thaliana) 		PF01565
(FAD_binding_4)
PF08031
(BBE) 		5 THR A 190
LEU A 191
LEU A 355
GLU A 159
LEU A 138
 None
 1.34A 2azqA-5d79A:
undetectable		 2azqA-5d79A:
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.
5e44 FNR REGULATOR

(Aliivibrio
fischeri) 		PF00027
(cNMP_binding)
PF13545
(HTH_Crp_2) 		5 LEU A 206
GLU A 168
ALA A 172
GLU A 156
LEU A 159
 None
None
MPD  A 302 ( 4.7A)
MPD  A 302 (-4.1A)
None
 1.38A 2azqA-5e44A:
undetectable		 2azqA-5e44A:
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.
5f5o NUCLEOPROTEIN

(Marburg
marburgvirus) 		PF05505
(Ebola_NP) 		5 GLU A 333
HIS A 330
ALA A 329
LEU A 325
LEU A 313
 None
 1.33A 2azqA-5f5oA:
undetectable		 2azqA-5f5oA:
24.17
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.
5fcc HUTD

(Pseudomonas
fluorescens) 		PF05962
(HutD) 		5 THR A  28
LEU A  42
HIS A 156
LEU A 154
LEU A  86
 None
 1.34A 2azqA-5fccA:
undetectable		 2azqA-5fccA:
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.
5gw5 T-COMPLEX PROTEIN 1
SUBUNIT THETA

(Saccharomyces
cerevisiae) 		PF00118
(Cpn60_TCP1) 		5 THR q 138
LEU q 139
GLU q 533
ALA q 531
LEU q 106
 None
 1.41A 2azqA-5gw5q:
undetectable		 2azqA-5gw5q:
22.20
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.
5hb4 NUP192,NUCLEOPORIN
NUP192

(Chaetomium
thermophilum) 		PF11894
(Nup192) 		5 THR B1464
LEU B1465
ALA B1500
LEU B1497
LEU B1586
 None
 1.31A 2azqA-5hb4B:
undetectable		 2azqA-5hb4B:
12.13
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.
5idt GLUCOSE-1-PHOSPHATE
THYMIDYLYLTRANSFERAS
E

(Burkholderia
vietnamiensis) 		PF00483
(NTP_transferase) 		5 THR A  43
LEU A 123
ALA A 106
TYR A 179
LEU A 107
 None
 1.36A 2azqA-5idtA:
undetectable		 2azqA-5idtA:
23.21
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.
5jjr GENOME POLYPROTEIN

(Dengue virus) 		PF00972
(Flavi_NS5)
PF01728
(FtsJ) 		5 THR A  34
LEU A 209
GLU A 216
LEU A 237
LEU A 204
 None
None
None
PEG  A1010 (-4.8A)
None
 1.37A 2azqA-5jjrA:
undetectable		 2azqA-5jjrA:
17.08
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.
5l9w ACETOPHENONE
CARBOXYLASE ALPHA
SUBUNIT

(Aromatoleum
aromaticum) 		PF01968
(Hydantoinase_A)
PF05378
(Hydant_A_N) 		5 LEU b 133
HIS b 202
ALA b 199
TYR b 200
LEU b 196
 None
 1.39A 2azqA-5l9wb:
undetectable		 2azqA-5l9wb:
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.
5lcw ANAPHASE-PROMOTING
COMPLEX SUBUNIT 1

(Homo sapiens) 		PF12859
(ANAPC1) 		5 HIS A1461
ALA A1460
TYR A1463
LEU A1404
LEU A1512
 None
 1.30A 2azqA-5lcwA:
undetectable		 2azqA-5lcwA:
9.55
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.
5lnx ACYL-COA
DEHYDROGENASE

(Bacillus
subtilis) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N) 		5 LEU A 135
HIS A 231
ALA A 233
LEU A 237
LEU A 223
 None
GOL  A 403 (-4.1A)
None
GOL  A 401 ( 4.5A)
None
 1.32A 2azqA-5lnxA:
undetectable		 2azqA-5lnxA:
21.99
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.
5sui RIBOSOME BIOGENESIS
PROTEIN NSA1

(Saccharomyces
cerevisiae) 		no annotation 5 THR A 289
LEU A 271
ALA A 211
TYR A 212
LEU A 231
 None
 1.33A 2azqA-5suiA:
undetectable		 2azqA-5suiA:
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.
5txw PEPTIDASE

(Thermococcus
thioreducens) 		PF01965
(DJ-1_PfpI) 		5 LEU A 165
ALA A  97
LEU A  67
GLU A  15
LEU A 154
 None
None
None
OCS  A 100 ( 2.4A)
None
 1.44A 2azqA-5txwA:
undetectable		 2azqA-5txwA:
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.
5u1b MTRE
PROTEIN,FERRITIN
CHIMERA

(Helicobacter
pylori;
Neisseria
gonorrhoeae) 		no annotation 5 LEU A  83
HIS A  93
ALA A  90
TYR A  91
GLU A 131
 None
 1.46A 2azqA-5u1bA:
0.5		 2azqA-5u1bA:
17.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5uak CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR

(Homo sapiens) 		PF00005
(ABC_tran)
PF00664
(ABC_membrane)
PF14396
(CFTR_R) 		5 LEU A1093
HIS A 199
ALA A 196
LEU A 197
GLU A  92
 None
 1.41A 2azqA-5uakA:
undetectable		 2azqA-5uakA:
11.80
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.
5vtm TYPE II SECRETION
SYSTEM PROTEIN J

(Pseudomonas
aeruginosa) 		no annotation 5 LEU W 115
ALA W  53
LEU W  50
GLU W  58
LEU W  61
 None
 1.42A 2azqA-5vtmW:
undetectable		 2azqA-5vtmW:
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.
5w6l RTX
REPEAT-CONTAINING
CYTOTOXIN

(Vibrio
vulnificus) 		no annotation 5 LEU A4016
ALA A4024
TYR A4026
LEU A3897
GLU A3930
 LEU  A4016 ( 0.6A)
ALA  A4024 ( 0.0A)
TYR  A4026 ( 1.3A)
LEU  A3897 ( 0.6A)
GLU  A3930 ( 0.6A)
 1.30A 2azqA-5w6lA:
undetectable		 2azqA-5w6lA:
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.
5wy3 PUTATIVE
UNCHARACTERIZED
PROTEIN

(Chaetomium
thermophilum) 		no annotation 5 THR A  31
GLU A  41
ALA A  37
TYR A 168
LEU A 249
 None
 1.31A 2azqA-5wy3A:
undetectable		 2azqA-5wy3A:
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.
5xbk IMPORTIN-4

(Homo sapiens) 		no annotation 5 THR D 885
GLU D 833
HIS D 834
ALA D 835
LEU D 800
 None
 1.45A 2azqA-5xbkD:
undetectable		 2azqA-5xbkD:
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.
5xd2 NUDIX FAMILY PROTEIN

(Mycolicibacterium
smegmatis) 		PF00293
(NUDIX)
PF00300
(His_Phos_1) 		5 THR A  73
LEU A  68
GLU A  84
ALA A  79
LEU A  92
 None
 1.27A 2azqA-5xd2A:
undetectable		 2azqA-5xd2A:
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.
5xd2 NUDIX FAMILY PROTEIN

(Mycolicibacterium
smegmatis) 		PF00293
(NUDIX)
PF00300
(His_Phos_1) 		5 THR A  73
LEU A  68
GLU A  84
HIS A  83
ALA A  79
 None
 1.08A 2azqA-5xd2A:
undetectable		 2azqA-5xd2A:
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.
5xei CHROMOSOME PARTITION
PROTEIN SMC

(Pyrococcus
yayanosii) 		PF02463
(SMC_N) 		5 GLU A 210
ALA A 214
TYR A 217
LEU A 218
GLU A 964
 None
 1.15A 2azqA-5xeiA:
undetectable		 2azqA-5xeiA:
20.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6ba5 VARIABLE DOMAIN OF
LIGHT CHAIN,
ANTIBODY R11
VARIABLE DOMAIN
HEAVY CHAIN,
ANTIBODY R11

(Homo sapiens;
Homo sapiens) 		no annotation
no annotation 		5 LEU A  90
GLU B  45
ALA B  59
TYR B  58
LEU B  77
 None
 1.47A 2azqA-6ba5A:
undetectable		 2azqA-6ba5A:
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.
6bq9 DNA TOPOISOMERASE 4
SUBUNIT A

(Pseudomonas
putida) 		no annotation 5 GLU A 194
HIS A 216
ALA A 196
LEU A 472
LEU A 350
 None
 1.20A 2azqA-6bq9A:
undetectable		 2azqA-6bq9A:
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.
6chj DIACYLGLYCEROL
O-ACYLTRANSFERASE

(Marinobacter
hydrocarbonoclasticus) 		no annotation 5 LEU A  10
HIS A 362
ALA A 360
LEU A 356
LEU A 208
 None
 1.42A 2azqA-6chjA:
undetectable		 2azqA-6chjA:
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.
6f07 SUPPRESSOR OF
KINETOCHORE PROTEIN
1

(Saccharomyces
cerevisiae) 		no annotation 5 LEU D  87
GLU D  92
HIS D  96
ALA D  94
LEU D 124
 None
 1.47A 2azqA-6f07D:
undetectable		 2azqA-6f07D:
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.
6gk6 -

(-) 		no annotation 5 THR A 294
HIS A 245
ALA A 243
LEU A 239
LEU A 359
 HEM  A 501 (-2.9A)
None
HEM  A 501 ( 3.5A)
HEM  A 501 ( 4.7A)
HEM  A 501 ( 4.5A)
 1.22A 2azqA-6gk6A:
0.0		 2azqA-6gk6A:
undetectable