SIMILAR PATTERNS OF AMINO ACIDS FOR 1NX9_B_AICB5002

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.
1csm CHORISMATE MUTASE

(Saccharomyces
cerevisiae) 		no annotation 4 ARG A  76
GLU A  82
HIS A 159
SER A 155
 None
 1.25A 1nx9B-1csmA:
undetectable		 1nx9B-1csmA:
17.87
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.
1dgj ALDEHYDE
OXIDOREDUCTASE

(Desulfovibrio
desulfuricans) 		PF00111
(Fer2)
PF01315
(Ald_Xan_dh_C)
PF01799
(Fer2_2)
PF02738
(Ald_Xan_dh_C2) 		4 TYR A 824
ARG A 363
GLN A 456
SER A 218
 None
 1.29A 1nx9B-1dgjA:
undetectable		 1nx9B-1dgjA:
21.93
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.
1ezw COENZYME
F420-DEPENDENT
N5,N10-METHYLENETETR
AHYDROMETHANOPTERIN
REDUCTASE

(Methanopyrus
kandleri) 		PF00296
(Bac_luciferase) 		4 TYR A 174
TYR A 229
GLN A 321
TYR A 139
 None
 1.02A 1nx9B-1ezwA:
undetectable		 1nx9B-1ezwA:
20.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1fsu N-ACETYLGALACTOSAMIN
E-4-SULFATASE

(Homo sapiens) 		PF00884
(Sulfatase) 		4 TYR A 251
TYR A 255
GLU A 250
TYR A 176
 None
 1.27A 1nx9B-1fsuA:
undetectable		 1nx9B-1fsuA:
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.
1hl2 N-ACETYLNEURAMINATE
LYASE SUBUNIT

(Escherichia
coli) 		PF00701
(DHDPS) 		4 TYR A 190
GLU A 192
SER A 208
TYR A 210
 None
 1.25A 1nx9B-1hl2A:
undetectable		 1nx9B-1hl2A:
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.
1kcl CYCLODEXTRIN
GLYCOSYLTRANSFERASE

(Bacillus
circulans) 		PF00128
(Alpha-amylase)
PF00686
(CBM_20)
PF01833
(TIG)
PF02806
(Alpha-amylase_C) 		4 TYR A 359
GLU A 257
HIS A 140
TYR A 195
 None
GLC  A1695 ( 2.6A)
GLC  A1695 (-3.8A)
GLC  A1694 (-4.3A)
 1.08A 1nx9B-1kclA:
undetectable		 1nx9B-1kclA:
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.
1lrz FACTOR ESSENTIAL FOR
EXPRESSION OF
METHICILLIN
RESISTANCE

(Staphylococcus
aureus) 		PF02388
(FemAB) 		4 TYR A 327
TYR A 361
GLN A 346
TYR A 225
 None
 1.11A 1nx9B-1lrzA:
undetectable		 1nx9B-1lrzA:
19.70
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.
1lsh LIPOVITELLIN (LV-1N,
LV-1C)

(Ichthyomyzon
unicuspis) 		PF01347
(Vitellogenin_N)
PF09172
(DUF1943) 		4 ARG A 679
TYR A 742
GLU A 545
SER A 649
 None
 1.33A 1nx9B-1lshA:
undetectable		 1nx9B-1lshA:
19.63
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.
1m4x PBCV-1 VIRUS CAPSID

(Paramecium
bursaria
Chlorella virus
1) 		PF04451
(Capsid_NCLDV)
PF16903
(Capsid_N) 		4 ARG A 363
GLU A 229
HIS A 108
TYR A 116
 None
 0.95A 1nx9B-1m4xA:
undetectable		 1nx9B-1m4xA:
20.27
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.
1mdf 2,3-DIHYDROXYBENZOAT
E-AMP LIGASE

(Bacillus
subtilis) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		4 ARG A 428
HIS A 398
SER A 402
TYR A 409
 None
 1.17A 1nx9B-1mdfA:
undetectable		 1nx9B-1mdfA:
21.86
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1mpx ALPHA-AMINO ACID
ESTER HYDROLASE

(Xanthomonas
citri) 		PF02129
(Peptidase_S15)
PF08530
(PepX_C) 		8 TYR A  82
ARG A  87
TYR A 123
GLU A 176
GLN A 226
HIS A 340
SER A 341
TYR A 345
 None
 0.32A 1nx9B-1mpxA:
55.8		 1nx9B-1mpxA:
60.23
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.
1mqt POLYPROTEIN

(Enterovirus B) 		PF00073
(Rhv) 		4 GLU A 127
GLN A 134
HIS A 222
SER A 233
 None
 1.29A 1nx9B-1mqtA:
undetectable		 1nx9B-1mqtA:
17.33
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.
1ofe FERREDOXIN-DEPENDENT
GLUTAMATE SYNTHASE 2

(Synechocystis
sp. PCC 6803) 		PF00310
(GATase_2)
PF01493
(GXGXG)
PF01645
(Glu_synthase)
PF04898
(Glu_syn_central) 		4 TYR A 911
ARG A 910
GLU A 906
TYR A 987
 None
 1.34A 1nx9B-1ofeA:
undetectable		 1nx9B-1ofeA:
18.76
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.
1qnl ALIPHATIC AMIDASE
EXPRESSION-REGULATIN
G PROTEIN

(Pseudomonas
aeruginosa) 		PF13433
(Peripla_BP_5) 		4 TYR A  83
TYR A 104
GLU A  24
TYR A 180
 BMD  A1001 (-3.0A)
None
None
None
 1.07A 1nx9B-1qnlA:
undetectable		 1nx9B-1qnlA:
20.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1rrv GLYCOSYLTRANSFERASE
GTFD

(Amycolatopsis
orientalis) 		PF03033
(Glyco_transf_28) 		4 GLU A 293
GLN A 297
HIS A 241
SER A 273
 GLU  A 293 (-0.6A)
GLN  A 297 ( 0.6A)
HIS  A 241 ( 1.0A)
SER  A 273 ( 0.0A)
 1.24A 1nx9B-1rrvA:
3.3		 1nx9B-1rrvA:
22.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1rvk ISOMERASE/LACTONIZIN
G ENZYME

(Agrobacterium
fabrum) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 ARG A 280
TYR A 243
SER A 136
TYR A 134
 MG  A 999 ( 4.9A)
None
None
None
 1.29A 1nx9B-1rvkA:
undetectable		 1nx9B-1rvkA:
20.64
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1ryy ALPHA-AMINO ACID
ESTER HYDROLASE

(Acetobacter
pasteurianus) 		PF02129
(Peptidase_S15)
PF08530
(PepX_C) 		8 TYR A 112
ARG A 117
TYR A 154
GLU A 207
GLN A 257
HIS A 370
SER A 371
TYR A 375
 None
 0.49A 1nx9B-1ryyA:
61.0		 1nx9B-1ryyA:
99.69
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.
1tu7 GLUTATHIONE
S-TRANSFERASE 2

(Onchocerca
volvulus) 		PF02798
(GST_N)
PF14497
(GST_C_3) 		4 ARG A  11
TYR A   7
GLU A 156
HIS A 161
 GOL  A2001 (-3.9A)
None
None
None
 1.02A 1nx9B-1tu7A:
undetectable		 1nx9B-1tu7A:
14.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1xmb IAA-AMINO ACID
HYDROLASE HOMOLOG 2

(Arabidopsis
thaliana) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		4 GLU A 173
GLN A 169
HIS A 135
TYR A 401
 None
 1.08A 1nx9B-1xmbA:
2.9		 1nx9B-1xmbA:
20.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1z6t APOPTOTIC PROTEASE
ACTIVATING FACTOR 1

(Homo sapiens) 		PF00619
(CARD)
PF00931
(NB-ARC) 		4 TYR A 529
GLU A 528
HIS A 521
SER A 193
 None
 1.34A 1nx9B-1z6tA:
undetectable		 1nx9B-1z6tA:
21.92
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.
2aua HYPOTHETICAL PROTEIN

(Bacillus cereus) 		PF10386
(DUF2441) 		4 ARG A  93
TYR A 168
GLU A  90
HIS A  30
 None
 0.91A 1nx9B-2auaA:
undetectable		 1nx9B-2auaA:
14.35
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.
2fja ADENYLYLSULFATE
REDUCTASE, SUBUNIT A

(Archaeoglobus
fulgidus) 		PF00890
(FAD_binding_2)
PF02910
(Succ_DH_flav_C) 		4 ARG A 317
HIS A 398
SER A 399
TYR A 599
 None
 1.11A 1nx9B-2fjaA:
undetectable		 1nx9B-2fjaA:
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.
2fpq BOTULINUM NEUROTOXIN
D LIGHT CHAIN

(Clostridium
botulinum) 		PF01742
(Peptidase_M27) 		4 TYR A 363
TYR A 367
GLU A 360
HIS A 236
 None
 1.33A 1nx9B-2fpqA:
undetectable		 1nx9B-2fpqA:
19.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2hke DIPHOSPHOMEVALONATE
DECARBOXYLASE,
PUTATIVE

(Trypanosoma
brucei) 		PF00288
(GHMP_kinases_N) 		4 TYR A 270
ARG A 274
TYR A 290
GLN A 252
 None
SO4  A 382 (-3.8A)
None
None
 1.20A 1nx9B-2hkeA:
undetectable		 1nx9B-2hkeA:
20.03
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.
2ihm DNA POLYMERASE MU

(Mus musculus) 		PF10391
(DNA_pol_lambd_f)
PF14716
(HHH_8)
PF14791
(DNA_pol_B_thumb)
PF14792
(DNA_pol_B_palm) 		4 TYR A 362
ARG A 418
TYR A 282
HIS A 366
 None
 1.23A 1nx9B-2ihmA:
undetectable		 1nx9B-2ihmA:
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.
2key PUTATIVE PHAGE
INTEGRASE

(Bacteroides
fragilis) 		PF13102
(Phage_int_SAM_5) 		4 TYR A  60
HIS A  11
SER A   9
TYR A  85
 None
 1.33A 1nx9B-2keyA:
undetectable		 1nx9B-2keyA:
9.33
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.
2ogs THERMOSTABLE
CARBOXYLESTERASE
EST50

(Geobacillus
stearothermophilus) 		PF00135
(COesterase) 		4 ARG A 369
TYR A 348
GLU A 373
SER A 224
 ARG  A 369 ( 0.6A)
TYR  A 348 ( 1.3A)
GLU  A 373 ( 0.5A)
SER  A 224 ( 0.0A)
 1.19A 1nx9B-2ogsA:
16.6		 1nx9B-2ogsA:
23.98
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.
2okc TYPE I RESTRICTION
ENZYME STYSJI M
PROTEIN

(Bacteroides
thetaiotaomicron) 		PF02384
(N6_Mtase)
PF12161
(HsdM_N) 		4 TYR A  38
TYR A  79
GLN A  35
SER A 224
 None
 1.19A 1nx9B-2okcA:
undetectable		 1nx9B-2okcA:
20.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2rkz FIBRONECTIN

(Homo sapiens) 		PF00039
(fn1) 		4 TYR A  75
GLU A  82
HIS A 111
SER A 116
 None
 1.27A 1nx9B-2rkzA:
undetectable		 1nx9B-2rkzA:
8.49
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.
2x56 COAGULASE/FIBRINOLYS
IN

(Yersinia pestis) 		PF01278
(Omptin) 		4 ARG A 211
HIS A 101
SER A  99
TYR A 150
 None
 1.29A 1nx9B-2x56A:
undetectable		 1nx9B-2x56A:
17.02
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.
2xe4 OLIGOPEPTIDASE B

(Leishmania
major) 		PF00326
(Peptidase_S9)
PF02897
(Peptidase_S9_N) 		4 GLU A 621
HIS A 697
SER A 577
TYR A 496
 None
PO4  A1791 ( 3.6A)
PO4  A1791 ( 3.4A)
PO4  A1793 (-3.1A)
 1.24A 1nx9B-2xe4A:
17.3		 1nx9B-2xe4A:
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.
2xfx MHC CLASS 1

(Bos taurus) 		PF00129
(MHC_I)
PF07654
(C1-set) 		4 TYR A  59
ARG A  62
GLU A  63
TYR A 159
 None
 1.31A 1nx9B-2xfxA:
undetectable		 1nx9B-2xfxA:
17.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ztg ALANYL-TRNA
SYNTHETASE

(Archaeoglobus
fulgidus) 		PF01411
(tRNA-synt_2c)
PF07973
(tRNA_SAD) 		4 ARG A  76
TYR A 161
GLU A 172
TYR A  68
 None
 1.25A 1nx9B-2ztgA:
undetectable		 1nx9B-2ztgA:
21.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3b02 TRANSCRIPTIONAL
REGULATOR, CRP
FAMILY

(Thermus
thermophilus) 		PF00027
(cNMP_binding)
PF13545
(HTH_Crp_2) 		4 TYR A  63
ARG A  13
TYR A  11
GLU A  32
 None
 1.24A 1nx9B-3b02A:
undetectable		 1nx9B-3b02A:
14.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3cdi POLYNUCLEOTIDE
PHOSPHORYLASE

(Escherichia
coli) 		PF01138
(RNase_PH)
PF03725
(RNase_PH_C)
PF03726
(PNPase) 		4 TYR A 403
GLU A 423
SER A 409
TYR A 408
 None
 1.21A 1nx9B-3cdiA:
undetectable		 1nx9B-3cdiA:
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.
3cfx UPF0100 PROTEIN
MA_0280

(Methanosarcina
acetivorans) 		PF13531
(SBP_bac_11) 		4 GLU A 227
GLN A 329
HIS A 252
SER A 231
 WO4  A 701 (-2.5A)
None
None
None
 1.32A 1nx9B-3cfxA:
undetectable		 1nx9B-3cfxA:
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.
3dka DINB-LIKE PROTEIN

(Bacillus
subtilis) 		PF05163
(DinB) 		4 ARG A  15
GLU A 128
HIS A  47
SER A  51
 None
 1.07A 1nx9B-3dkaA:
undetectable		 1nx9B-3dkaA:
13.79
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.
3fed GLUTAMATE
CARBOXYPEPTIDASE III

(Homo sapiens) 		PF02225
(PA)
PF04253
(TFR_dimer)
PF04389
(Peptidase_M28) 		4 TYR A 542
TYR A 224
GLU A 547
HIS A 367
 BIX  A   1 (-4.7A)
None
None
ZN  A1752 ( 3.3A)
 1.12A 1nx9B-3fedA:
3.4		 1nx9B-3fedA:
21.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3fip OUTER MEMBRANE USHER
PROTEIN PAPC

(Escherichia
coli) 		PF00577
(Usher) 		4 ARG A 316
GLU A 269
GLN A 595
SER A 557
 None
 1.34A 1nx9B-3fipA:
undetectable		 1nx9B-3fipA:
22.19
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.
3fkd L-THREONINE-O-3-PHOS
PHATE DECARBOXYLASE

(Porphyromonas
gingivalis) 		PF00155
(Aminotran_1_2) 		4 ARG A 218
GLN A  82
HIS A 111
SER A  90
 None
 1.10A 1nx9B-3fkdA:
undetectable		 1nx9B-3fkdA:
18.69
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.
3gor PUTATIVE
METAL-DEPENDENT
HYDROLASE

(Geobacillus
stearothermophilus) 		PF05163
(DinB) 		4 ARG A  15
GLU A 128
HIS A  47
SER A  51
 None
None
NI  A 200 (-3.5A)
None
 1.05A 1nx9B-3gorA:
undetectable		 1nx9B-3gorA:
13.05
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.
3hpx 2-ISOPROPYLMALATE
SYNTHASE

(Mycobacterium
tuberculosis) 		PF00682
(HMGL-like) 		4 TYR A 107
GLU A 309
HIS A 287
TYR A 263
 None
None
NI  A 701 (-3.3A)
None
 1.32A 1nx9B-3hpxA:
undetectable		 1nx9B-3hpxA:
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.
3i9v NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT 1
NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT 2

(Thermus
thermophilus) 		PF01257
(2Fe-2S_thioredx)
PF01512
(Complex1_51K)
PF10531
(SLBB)
PF10589
(NADH_4Fe-4S) 		4 TYR 2  69
GLU 1 137
GLN 2  35
TYR 1 133
 None
 1.11A 1nx9B-3i9v2:
undetectable		 1nx9B-3i9v2:
14.53
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.
3i9v NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT 3

(Thermus
thermophilus) 		PF00384
(Molybdopterin)
PF01568
(Molydop_binding)
PF04879
(Molybdop_Fe4S4)
PF10588
(NADH-G_4Fe-4S_3)
PF13510
(Fer2_4) 		4 ARG 3 469
TYR 3 759
GLU 3 472
SER 3 487
 None
 1.24A 1nx9B-3i9v3:
undetectable		 1nx9B-3i9v3:
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.
3ifs GLUCOSE-6-PHOSPHATE
ISOMERASE

(Bacillus
anthracis) 		PF00342
(PGI) 		4 ARG A  25
GLU A 245
GLN A 253
HIS A  32
 None
 1.17A 1nx9B-3ifsA:
undetectable		 1nx9B-3ifsA:
21.69
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.
3jb9 PRE-MRNA-PROCESSING
PROTEIN 45
PRE-MRNA-SPLICING
FACTOR CWF4

(Schizosaccharomyces
pombe) 		PF02184
(HAT)
PF02731
(SKIP_SNW) 		4 ARG R 124
TYR M 103
GLU R 148
GLN R 159
 None
 1.16A 1nx9B-3jb9R:
undetectable		 1nx9B-3jb9R:
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.
3m7p FN1 PROTEIN

(Homo sapiens) 		PF00039
(fn1)
PF00040
(fn2) 		4 ARG A 592
GLU A 596
HIS A 535
TYR A 366
 None
ZN  A 955 ( 3.9A)
ZN  A 954 (-3.2A)
12P  A 189 ( 4.7A)
 1.27A 1nx9B-3m7pA:
undetectable		 1nx9B-3m7pA:
17.90
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.
3mvc GLOBIN PROTEIN 6

(Caenorhabditis
elegans) 		PF00042
(Globin) 		4 ARG A 313
GLU A 316
GLN A 328
HIS A 211
 None
 1.15A 1nx9B-3mvcA:
undetectable		 1nx9B-3mvcA:
13.25
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.
3n6r PROPIONYL-COA
CARBOXYLASE, ALPHA
SUBUNIT

(Ruegeria
pomeroyi) 		PF00289
(Biotin_carb_N)
PF00364
(Biotin_lipoyl)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2) 		4 ARG A 399
GLU A 301
HIS A 358
TYR A 143
 None
 1.30A 1nx9B-3n6rA:
undetectable		 1nx9B-3n6rA:
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.
3nwo PROLINE
IMINOPEPTIDASE

(Mycolicibacterium
smegmatis) 		PF00561
(Abhydrolase_1) 		4 ARG A 271
GLN A 296
HIS A 108
SER A 132
 None
 1.20A 1nx9B-3nwoA:
15.2		 1nx9B-3nwoA:
21.42
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.
3o9p PERIPLASMIC MUREIN
PEPTIDE-BINDING
PROTEIN

(Escherichia
coli) 		PF00496
(SBP_bac_5) 		4 ARG A 402
GLN A 393
HIS A 369
TYR A 272
 MHI  A 516 (-2.8A)
None
None
None
 1.30A 1nx9B-3o9pA:
undetectable		 1nx9B-3o9pA:
21.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3rko NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT L
NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT M

(Escherichia
coli) 		no annotation 4 TYR L 140
GLU M 407
SER M 321
TYR M 435
 None
 1.29A 1nx9B-3rkoL:
undetectable		 1nx9B-3rkoL:
21.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3rv2 S-ADENOSYLMETHIONINE
SYNTHASE

(Mycobacterium
marinum) 		PF00438
(S-AdoMet_synt_N)
PF02772
(S-AdoMet_synt_M)
PF02773
(S-AdoMet_synt_C) 		4 ARG A 314
GLU A 313
HIS A 233
TYR A 188
 None
 1.09A 1nx9B-3rv2A:
undetectable		 1nx9B-3rv2A:
22.09
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.
3slc ACETATE KINASE

(Salmonella
enterica) 		PF00871
(Acetate_kinase) 		4 ARG A 178
GLN A 155
HIS A 186
TYR A 317
 None
 1.27A 1nx9B-3slcA:
undetectable		 1nx9B-3slcA:
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.
3sn0 PUTATIVE
L-ALANINE-DL-GLUTAMA
TE EPIMERASE

(Paraburkholderia
xenovorans) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 TYR A 227
GLU A 243
HIS A 123
SER A 122
 None
MG  A 408 (-3.2A)
FUM  A 500 (-4.0A)
None
 1.27A 1nx9B-3sn0A:
undetectable		 1nx9B-3sn0A:
20.73
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.
3t6c PUTATIVE MAND FAMILY
DEHYDRATASE

(Pantoea
ananatis) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 TYR A 158
TYR A 199
GLN A 154
HIS A 325
 GCO  A 601 (-4.4A)
None
None
GCO  A 601 (-3.9A)
 1.18A 1nx9B-3t6cA:
undetectable		 1nx9B-3t6cA:
20.85
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.
3wj2 CARBOXYLESTERASE

(Ferroplasma
acidiphilum) 		PF07859
(Abhydrolase_3) 		4 ARG A 275
GLU A 258
SER A 195
TYR A 199
 None
 1.34A 1nx9B-3wj2A:
16.4		 1nx9B-3wj2A:
18.85
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.
3wqy ALANINE--TRNA LIGASE

(Archaeoglobus
fulgidus) 		PF01411
(tRNA-synt_2c)
PF02272
(DHHA1)
PF07973
(tRNA_SAD) 		4 ARG A  76
TYR A 161
GLU A 172
TYR A  68
 None
 1.32A 1nx9B-3wqyA:
undetectable		 1nx9B-3wqyA:
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.
3wrf NON-REDUCING END
BETA-L-ARABINOFURANO
SIDASE

(Bifidobacterium
longum) 		PF07944
(Glyco_hydro_127) 		4 TYR A 145
GLU A  83
SER A 428
TYR A 432
 None
 1.07A 1nx9B-3wrfA:
undetectable		 1nx9B-3wrfA:
22.79
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.
3wuf ENDO-1,4-BETA-XYLANA
SE A

(Streptomyces
sp.) 		PF00331
(Glyco_hydro_10) 		4 TYR A  89
GLU A  82
GLN A 126
SER A 318
 None
ZN  A 401 (-2.1A)
None
None
 1.23A 1nx9B-3wufA:
undetectable		 1nx9B-3wufA:
19.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4eqf PEX5-RELATED PROTEIN

(Mus musculus) 		PF13181
(TPR_8)
PF13432
(TPR_16) 		4 TYR A 239
ARG A 236
TYR A 224
GLU A  67
 None
 1.19A 1nx9B-4eqfA:
undetectable		 1nx9B-4eqfA:
20.18
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.
4hn3 LMO1757 PROTEIN

(Listeria
monocytogenes) 		PF07537
(CamS) 		4 ARG A 298
TYR A 223
GLU A 300
HIS A 269
 None
None
PEG  A 403 (-3.1A)
None
 1.16A 1nx9B-4hn3A:
2.1		 1nx9B-4hn3A:
21.92
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.
4hpn PUTATIVE
UNCHARACTERIZED
PROTEIN

(Agrobacterium
fabrum) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 TYR A 132
GLN A 267
HIS A 197
SER A  23
 None
 1.31A 1nx9B-4hpnA:
undetectable		 1nx9B-4hpnA:
20.46
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.
4lu4 PUTATIVE CELL
FILAMENTATION
PROTEIN

(Bartonella
quintana) 		PF02661
(Fic) 		4 ARG A  42
GLU A 161
GLN A 208
SER A 174
 None
 1.29A 1nx9B-4lu4A:
undetectable		 1nx9B-4lu4A:
15.60
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.
4lua N-ACETYLTRANSFERASE

(Staphylococcus
aureus) 		PF13420
(Acetyltransf_4) 		4 TYR A  85
TYR A  15
GLU A  25
SER A 118
 None
 1.19A 1nx9B-4luaA:
undetectable		 1nx9B-4luaA:
13.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4mo2 UDP-GALACTOPYRANOSE
MUTASE

(Campylobacter
jejuni) 		no annotation 4 ARG B 277
TYR B 268
GLN B 261
HIS B  51
 None
 1.30A 1nx9B-4mo2B:
undetectable		 1nx9B-4mo2B:
17.77
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.
4nzr PROTEIN M TD

(Mycoplasma
genitalium) 		no annotation 4 TYR M 233
GLU M 311
SER M 291
TYR M 315
 None
 1.31A 1nx9B-4nzrM:
undetectable		 1nx9B-4nzrM:
20.35
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4pf1 PEPTIDASE
S15/COCE/NOND

(Thaumarchaeota
archaeon SCGC
AB-539-E09) 		PF02129
(Peptidase_S15)
PF08530
(PepX_C) 		6 TYR A  66
ARG A  71
TYR A 107
GLU A 160
GLN A 211
HIS A 325
 None
 0.29A 1nx9B-4pf1A:
52.3		 1nx9B-4pf1A:
48.68
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.
4ppu CHORISMATE MUTASE 1,
CHLOROPLASTIC

(Arabidopsis
thaliana) 		no annotation 4 ARG A 150
GLU A 156
HIS A 231
SER A 227
 TYR  A 401 (-4.5A)
TYR  A 401 ( 4.5A)
None
None
 1.30A 1nx9B-4ppuA:
undetectable		 1nx9B-4ppuA:
16.85
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.
4qjy GH127
BETA-L-ARABINOFURANO
SIDASE

(Geobacillus
stearothermophilus) 		PF07944
(Glyco_hydro_127) 		4 TYR A 136
GLU A  78
SER A 417
TYR A 421
 ACT  A 701 (-4.4A)
None
ACT  A 703 ( 4.0A)
None
 1.05A 1nx9B-4qjyA:
undetectable		 1nx9B-4qjyA:
22.83
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.
4qlb PROBABLE GLYCOGEN
[STARCH] SYNTHASE

(Caenorhabditis
elegans) 		PF05693
(Glycogen_syn) 		4 GLU A 263
GLN A 201
HIS A 230
TYR A 530
 None
 1.26A 1nx9B-4qlbA:
5.0		 1nx9B-4qlbA:
21.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ru5 TAILSPIKE GP27

(Pseudomonas
phage phi297) 		no annotation 4 ARG A 497
TYR A 527
HIS A 421
TYR A 330
 None
 1.22A 1nx9B-4ru5A:
undetectable		 1nx9B-4ru5A:
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.
4upk PHOSPHONATE
MONOESTER HYDROLASE

(Ruegeria
pomeroyi) 		PF00884
(Sulfatase) 		4 TYR A 101
GLU A 122
HIS A 214
TYR A 160
 None
 1.11A 1nx9B-4upkA:
undetectable		 1nx9B-4upkA:
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.
4uw2 CSM1

(Thermococcus
onnurineus) 		PF01966
(HD) 		4 ARG A 755
GLU A 757
GLN A 759
HIS A 676
 None
 1.26A 1nx9B-4uw2A:
undetectable		 1nx9B-4uw2A:
22.26
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.
4xsy RNA POLYMERASE SIGMA
FACTOR RPOD

(Escherichia
coli) 		PF00140
(Sigma70_r1_2)
PF04539
(Sigma70_r3)
PF04542
(Sigma70_r2)
PF04545
(Sigma70_r4)
PF04546
(Sigma70_ner) 		4 GLU F 139
GLN F 346
SER F 272
TYR F 268
 None
 1.33A 1nx9B-4xsyF:
undetectable		 1nx9B-4xsyF:
21.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4y23 GAMMA GLUTAMYL
TRANSPEPTIDASE,GAMMA
-GLUTAMYLTRANSPEPTID
ASE

(Bacillus
licheniformis) 		PF01019
(G_glu_transpept) 		4 ARG A 511
TYR A 317
GLU A 523
SER A 569
 None
 1.11A 1nx9B-4y23A:
undetectable		 1nx9B-4y23A:
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.
4y9w ASPARTIC ACID
ENDOPEPTIDASE SAPP2

(Candida
parapsilosis) 		PF00026
(Asp) 		4 ARG A 305
GLU A 273
GLN A 322
SER A 217
 None
 1.05A 1nx9B-4y9wA:
undetectable		 1nx9B-4y9wA:
18.33
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.
4zb1 BLUE CHROMOPROTEIN,
SGBP

(Stichodactyla
gigantea) 		PF01353
(GFP) 		4 GLN A 105
HIS A 196
SER A 194
TYR A  71
 CRQ  A  62 ( 4.0A)
CRQ  A  62 ( 3.7A)
None
None
 1.25A 1nx9B-4zb1A:
undetectable		 1nx9B-4zb1A:
15.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5an1 GLUTATHIONE
S-TRANSFERASE

(Litopenaeus
vannamei) 		PF02798
(GST_N)
PF14497
(GST_C_3) 		4 ARG A  11
TYR A   7
GLU A 160
HIS A 165
 None
 1.08A 1nx9B-5an1A:
undetectable		 1nx9B-5an1A:
14.70
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.
5c6g AGR133CP
SISTER CHROMATID
COHESION PROTEIN 2

(Eremothecium
gossypii) 		PF10345
(Cohesin_load)
no annotation 		4 ARG B  35
GLU B  32
GLN A 278
SER A 452
 None
 0.94A 1nx9B-5c6gB:
undetectable		 1nx9B-5c6gB:
16.69
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.
5d62 AGGLUTININ

(Marasmius
oreades) 		PF14200
(RicinB_lectin_2) 		4 ARG A   4
GLU A 162
SER A 157
TYR A   8
 None
 1.22A 1nx9B-5d62A:
undetectable		 1nx9B-5d62A:
16.67
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.
5d73 GLUTATHIONE
S-TRANSFERASE

(Wuchereria
bancrofti) 		PF02798
(GST_N)
PF14497
(GST_C_3) 		4 ARG A  11
TYR A   7
GLU A 156
HIS A 161
 None
 1.02A 1nx9B-5d73A:
undetectable		 1nx9B-5d73A:
14.90
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.
5f7u CYCLOALTERNAN-FORMIN
G ENZYME

(Listeria
monocytogenes) 		PF01055
(Glyco_hydro_31)
PF13802
(Gal_mutarotas_2)
PF16338
(DUF4968)
PF16990
(CBM_35) 		4 TYR A 939
TYR A 947
GLU A 910
HIS A1086
 None
 1.22A 1nx9B-5f7uA:
undetectable		 1nx9B-5f7uA:
22.10
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.
5huq LACTATE RACEMIZATION
OPERON PROTEIN LARA

(Lactobacillus
plantarum) 		PF09861
(DUF2088) 		4 ARG A 350
GLU A 203
GLN A 357
SER A 219
 SO4  A 509 (-4.5A)
SO4  A 509 (-4.7A)
None
None
 1.30A 1nx9B-5huqA:
undetectable		 1nx9B-5huqA:
20.41
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.
5i8i UREA AMIDOLYASE

(Kluyveromyces
lactis) 		PF00289
(Biotin_carb_N)
PF01425
(Amidase)
PF02626
(CT_A_B)
PF02682
(CT_C_D)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2) 		4 ARG A1439
TYR A1379
SER A1104
TYR A1085
 None
 1.25A 1nx9B-5i8iA:
3.1		 1nx9B-5i8iA:
17.11
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.
5ik2 ATP SYNTHASE SUBUNIT
ALPHA

(Caldalkalibacillus
thermarum) 		PF00006
(ATP-synt_ab)
PF00306
(ATP-synt_ab_C)
PF02874
(ATP-synt_ab_N) 		4 ARG A 296
TYR A 270
GLU A 130
GLN A  64
 None
 0.93A 1nx9B-5ik2A:
undetectable		 1nx9B-5ik2A:
22.69
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.
5im3 RIBONUCLEOSIDE-DIPHO
SPHATE REDUCTASE

(Pseudomonas
aeruginosa) 		PF00317
(Ribonuc_red_lgN)
PF02867
(Ribonuc_red_lgC)
PF03477
(ATP-cone) 		4 TYR A 121
ARG A 125
TYR A 124
GLU A 106
 DTP  A1002 ( 3.6A)
None
DTP  A1002 (-3.4A)
None
 1.33A 1nx9B-5im3A:
undetectable		 1nx9B-5im3A:
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.
5jbo BETA-GLUCOSIDASE

(Trichoderma
harzianum) 		PF00232
(Glyco_hydro_1) 		4 TYR A 181
ARG A 190
GLU A 205
GLN A 176
 None
 1.28A 1nx9B-5jboA:
undetectable		 1nx9B-5jboA:
20.03
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.
5jou ALPHA-XYLOSIDASE
BOGH31A

(Bacteroides
ovatus) 		PF01055
(Glyco_hydro_31)
PF16338
(DUF4968)
PF17137
(DUF5110) 		4 TYR A 686
GLU A 682
GLN A 673
TYR A 830
 None
 1.25A 1nx9B-5jouA:
undetectable		 1nx9B-5jouA:
20.69
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.
5jyd SHORT CHAIN
DEHYDROGENASE

(Burkholderia
cenocepacia) 		PF13561
(adh_short_C2) 		4 ARG A 211
TYR A 219
GLN A 257
SER A 274
 IOD  A 904 ( 3.8A)
NAD  A 901 (-4.6A)
NAD  A 901 (-3.7A)
None
 1.20A 1nx9B-5jydA:
5.2		 1nx9B-5jydA:
20.21
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.
5kzm TRYPTOPHAN SYNTHASE
ALPHA CHAIN
TRYPTOPHAN SYNTHASE
BETA CHAIN

(Francisella
tularensis) 		PF00290
(Trp_syntA)
PF00291
(PALP) 		4 TYR A 116
GLN A 151
HIS A 135
TYR B   7
 None
 1.27A 1nx9B-5kzmA:
undetectable		 1nx9B-5kzmA:
17.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5olk RIBONUCLEOSIDE-DIPHO
SPHATE REDUCTASE,
BETA SUBUNIT 1

(Leeuwenhoekiella
blandensis) 		no annotation 4 TYR A  91
ARG A  95
TYR A  94
GLU A  76
 DTP  A1002 ( 3.6A)
None
DTP  A1002 (-3.5A)
None
 1.26A 1nx9B-5olkA:
undetectable		 1nx9B-5olkA:
8.19
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.
5ols RHAMNOGALACTURONAN
LYASE

(Bacteroides
thetaiotaomicron) 		no annotation 4 TYR A 184
ARG A 160
GLU A 157
HIS A 153
 None
None
None
ADA  A 604 ( 3.9A)
 1.27A 1nx9B-5olsA:
undetectable		 1nx9B-5olsA:
22.42
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.
5w6y CHORISMATE MUTASE

(Physcomitrella
patens) 		no annotation 4 ARG A 135
GLU A 141
HIS A 216
SER A 212
 None
 1.34A 1nx9B-5w6yA:
undetectable		 1nx9B-5w6yA:
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.
5wtk CRISPR-ASSOCIATED
ENDORIBONUCLEASE
C2C2

(Leptotrichia
shahii) 		no annotation 4 ARG A 491
TYR A1241
GLU A1208
HIS A 483
 None
 1.18A 1nx9B-5wtkA:
undetectable		 1nx9B-5wtkA:
16.40
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.
5x7s GLYCOSIDE HYDROLASE
FAMILY 31
ALPHA-GLUCOSIDASE

(Paenibacillus
sp. 598K) 		PF01055
(Glyco_hydro_31)
PF16338
(DUF4968)
PF16990
(CBM_35)
PF17137
(DUF5110) 		4 ARG A 468
TYR A 456
SER A 746
TYR A 732
 None
 1.25A 1nx9B-5x7sA:
undetectable		 1nx9B-5x7sA:
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.
5y3r X-RAY REPAIR
CROSS-COMPLEMENTING
PROTEIN 5

(Homo sapiens) 		PF02735
(Ku)
PF03730
(Ku_C)
PF03731
(Ku_N) 		4 ARG B 394
TYR B 421
GLN B 423
TYR B 333
 None
 1.31A 1nx9B-5y3rB:
2.4		 1nx9B-5y3rB:
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.
6bgd GLUCOSE/GALACTOSE-BI
NDING LIPOPROTEIN

(Treponema
pallidum) 		no annotation 4 ARG A  20
TYR A 318
GLN A 215
HIS A  89
 None
None
EDO  A 410 ( 4.5A)
None
 1.26A 1nx9B-6bgdA:
3.6		 1nx9B-6bgdA:
9.73
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.
6bnf PHOSPHOETHANOLAMINE
TRANSFERASE

(Moraxella sp.
HMSC061H09) 		no annotation 4 TYR A 433
GLU A 273
HIS A 549
SER A 318
 None
ZN  A 602 (-2.3A)
None
None
 1.23A 1nx9B-6bnfA:
undetectable		 1nx9B-6bnfA:
8.89
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.
6ces RAS-RELATED
GTP-BINDING PROTEIN
A
RAS-RELATED
GTP-BINDING PROTEIN
C

(Homo sapiens) 		no annotation 4 ARG A  34
GLN A 237
HIS C 223
TYR C 216
 None
 1.06A 1nx9B-6cesA:
undetectable		 1nx9B-6cesA:
8.57