SIMILAR PATTERNS OF AMINO ACIDS FOR 2QMZ_B_LDPB502

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.
1a6a HLA CLASS II
HISTOCOMPATIBILITY
ANTIGEN, DR ALPHA
CHAIN


(Homo sapiens)
PF00993
(MHC_II_alpha)
PF07654
(C1-set)
4 GLN A   9
PHE A  24
PHE A  32
GLY A  58
None
1.04A 2qmzA-1a6aA:
undetectable
2qmzB-1a6aA:
undetectable
2qmzA-1a6aA:
24.35
2qmzB-1a6aA:
24.35
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.
1c7g TYROSINE
PHENOL-LYASE


(Pantoea
agglomerans)
PF01212
(Beta_elim_lyase)
4 GLN A 364
PHE A 453
PHE A 439
GLY A 387
None
1.30A 2qmzA-1c7gA:
2.5
2qmzB-1c7gA:
2.9
2qmzA-1c7gA:
19.22
2qmzB-1c7gA:
19.22
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.
1fkm PROTEIN (GYP1P)

(Saccharomyces
cerevisiae)
PF00566
(RabGAP-TBC)
4 PHE A 387
PHE A 391
TRP A 290
GLY A 295
None
1.25A 2qmzA-1fkmA:
0.0
2qmzB-1fkmA:
undetectable
2qmzA-1fkmA:
20.25
2qmzB-1fkmA:
20.25
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.
1gz4 NAD-DEPENDENT MALIC
ENZYME


(Homo sapiens)
PF00390
(malic)
PF03949
(Malic_M)
4 GLN A 253
PHE A 276
PHE A 491
GLY A 473
None
1.19A 2qmzA-1gz4A:
3.0
2qmzB-1gz4A:
2.9
2qmzA-1gz4A:
17.19
2qmzB-1gz4A:
17.19
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.
1h39 SQUALENE--HOPENE
CYCLASE


(Alicyclobacillus
acidocaldarius)
PF13243
(SQHop_cyclase_C)
PF13249
(SQHop_cyclase_N)
4 PHE A 404
PHE A 456
TRP A 465
GLY A 409
None
1.41A 2qmzA-1h39A:
undetectable
2qmzB-1h39A:
undetectable
2qmzA-1h39A:
16.29
2qmzB-1h39A:
16.29
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.
1h4u NIDOGEN-1

(Mus musculus)
PF07474
(G2F)
4 GLN A 505
PHE A 507
PHE A 486
GLY A 465
None
1.33A 2qmzA-1h4uA:
undetectable
2qmzB-1h4uA:
undetectable
2qmzA-1h4uA:
23.13
2qmzB-1h4uA:
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.
1iid PEPTIDE
N-MYRISTOYLTRANSFERA
SE


(Saccharomyces
cerevisiae)
PF01233
(NMT)
PF02799
(NMT_C)
4 GLN A 287
PHE A 289
PHE A 276
GLY A 451
None
1.41A 2qmzA-1iidA:
undetectable
2qmzB-1iidA:
undetectable
2qmzA-1iidA:
17.42
2qmzB-1iidA:
17.42
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.
1kbl PYRUVATE PHOSPHATE
DIKINASE


([Clostridium]
symbiosum)
PF00391
(PEP-utilizers)
PF01326
(PPDK_N)
PF02896
(PEP-utilizers_C)
4 GLN A 680
PHE A 566
PHE A 626
GLY A 666
None
1.09A 2qmzA-1kblA:
0.2
2qmzB-1kblA:
0.2
2qmzA-1kblA:
14.04
2qmzB-1kblA:
14.04
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.
1l0q SURFACE LAYER
PROTEIN


(Methanosarcina
mazei)
PF00801
(PKD)
PF10282
(Lactonase)
4 PHE A 309
PHE A 326
TRP A 338
GLY A 341
None
1.17A 2qmzA-1l0qA:
0.0
2qmzB-1l0qA:
undetectable
2qmzA-1l0qA:
19.21
2qmzB-1l0qA:
19.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1mhm S-ADENOSYLMETHIONINE
DECARBOXYLASE


(Solanum
tuberosum)
PF01536
(SAM_decarbox)
4 GLN A 332
PHE A 334
PHE A 289
GLY A 274
None
1.25A 2qmzA-1mhmA:
undetectable
2qmzB-1mhmA:
undetectable
2qmzA-1mhmA:
21.05
2qmzB-1mhmA:
21.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1nsv GALACTOSE MUTAROTASE

(Lactococcus
lactis)
PF01263
(Aldose_epim)
4 GLN A 235
PHE A 195
PHE A 246
GLY A 241
None
1.29A 2qmzA-1nsvA:
undetectable
2qmzB-1nsvA:
undetectable
2qmzA-1nsvA:
22.65
2qmzB-1nsvA:
22.65
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.
1tl2 PROTEIN
(TACHYLECTIN-2)


(Tachypleus
tridentatus)
PF14517
(Tachylectin)
4 GLN A 199
PHE A 184
TRP A 216
GLY A 179
None
None
None
NDG  A 241 (-4.7A)
1.29A 2qmzA-1tl2A:
undetectable
2qmzB-1tl2A:
undetectable
2qmzA-1tl2A:
24.06
2qmzB-1tl2A:
24.06
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.
1w6j LANOSTEROL SYNTHASE

(Homo sapiens)
PF13243
(SQHop_cyclase_C)
PF13249
(SQHop_cyclase_N)
4 PHE A 391
PHE A 711
TRP A 590
GLY A 582
None
1.22A 2qmzA-1w6jA:
undetectable
2qmzB-1w6jA:
undetectable
2qmzA-1w6jA:
17.08
2qmzB-1w6jA:
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.
1wac P2 PROTEIN

(Pseudomonas
virus phi6)
PF00680
(RdRP_1)
4 GLN A 525
PHE A 526
PHE A  53
TRP A 575
None
1.34A 2qmzA-1wacA:
undetectable
2qmzB-1wacA:
undetectable
2qmzA-1wacA:
16.54
2qmzB-1wacA:
16.54
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.
1xr5 GENOME POLYPROTEIN

(Rhinovirus B)
PF00680
(RdRP_1)
4 GLN A 340
PHE A 362
PHE A 232
GLY A 346
None
1.11A 2qmzA-1xr5A:
undetectable
2qmzB-1xr5A:
undetectable
2qmzA-1xr5A:
19.40
2qmzB-1xr5A:
19.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1xv2 HYPOTHETICAL
PROTEIN, SIMILAR TO
ALPHA-ACETOLACTATE
DECARBOXYLASE


(Staphylococcus
aureus)
PF03306
(AAL_decarboxy)
4 GLN A 200
PHE A 202
PHE A 158
GLY A  32
None
1.38A 2qmzA-1xv2A:
undetectable
2qmzB-1xv2A:
undetectable
2qmzA-1xv2A:
24.62
2qmzB-1xv2A:
24.62
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.
1xv2 HYPOTHETICAL
PROTEIN, SIMILAR TO
ALPHA-ACETOLACTATE
DECARBOXYLASE


(Staphylococcus
aureus)
PF03306
(AAL_decarboxy)
4 GLN A 207
PHE A 205
PHE A 109
GLY A 166
None
1.25A 2qmzA-1xv2A:
undetectable
2qmzB-1xv2A:
undetectable
2qmzA-1xv2A:
24.62
2qmzB-1xv2A:
24.62
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.
1y9g EXO-INULINASE

(Aspergillus
awamori)
PF00251
(Glyco_hydro_32N)
PF08244
(Glyco_hydro_32C)
4 PHE A 280
PHE A 230
TRP A 240
GLY A 244
None
1.27A 2qmzA-1y9gA:
undetectable
2qmzB-1y9gA:
undetectable
2qmzA-1y9gA:
18.57
2qmzB-1y9gA:
18.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2c4x ENDOGLUCANASE

(Ruminiclostridium
thermocellum)
PF00801
(PKD)
4 PHE A  11
PHE A  26
TRP A  43
GLY A  46
None
1.13A 2qmzA-2c4xA:
undetectable
2qmzB-2c4xA:
undetectable
2qmzA-2c4xA:
22.74
2qmzB-2c4xA:
22.74
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.
2co8 NEDD9 INTERACTING
PROTEIN WITH
CALPONIN HOMOLOGY
AND LIM DOMAINS


(Homo sapiens)
PF00412
(LIM)
4 GLN A  59
PHE A  66
PHE A  43
GLY A  35
None
1.43A 2qmzA-2co8A:
undetectable
2qmzB-2co8A:
undetectable
2qmzA-2co8A:
16.59
2qmzB-2co8A:
16.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2dar PDZ AND LIM DOMAIN
PROTEIN 5


(Homo sapiens)
PF00412
(LIM)
4 GLN A  14
PHE A  66
PHE A  52
GLY A  44
None
1.08A 2qmzA-2darA:
undetectable
2qmzB-2darA:
undetectable
2qmzA-2darA:
17.47
2qmzB-2darA:
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.
2f9q CYTOCHROME P450 2D6

(Homo sapiens)
PF00067
(p450)
4 PHE A 420
PHE A 433
TRP A 409
GLY A 367
None
1.25A 2qmzA-2f9qA:
undetectable
2qmzB-2f9qA:
undetectable
2qmzA-2f9qA:
19.42
2qmzB-2f9qA:
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.
2g29 NITRATE TRANSPORT
PROTEIN NRTA


(Synechocystis
sp.)
PF13379
(NMT1_2)
4 GLN A 255
PHE A 335
PHE A 342
GLY A 260
None
1.18A 2qmzA-2g29A:
undetectable
2qmzB-2g29A:
undetectable
2qmzA-2g29A:
19.46
2qmzB-2g29A:
19.46
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.
2gpc IRON SUPEROXIDE
DISMUTASE


(Trypanosoma
cruzi)
PF00081
(Sod_Fe_N)
PF02777
(Sod_Fe_C)
4 GLN A 193
PHE A  77
PHE A  73
TRP A 126
None
1.06A 2qmzA-2gpcA:
undetectable
2qmzB-2gpcA:
undetectable
2qmzA-2gpcA:
20.59
2qmzB-2gpcA:
20.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2iiz MELANIN BIOSYNTHESIS
PROTEIN TYRA,
PUTATIVE


(Shewanella
oneidensis)
PF04261
(Dyp_perox)
4 GLN A 308
PHE A 305
PHE A 174
TRP A  70
None
1.32A 2qmzA-2iizA:
undetectable
2qmzB-2iizA:
undetectable
2qmzA-2iizA:
21.56
2qmzB-2iizA:
21.56
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.
2m2a FKBP-TYPE 16 KDA
PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE


(Escherichia
coli)
PF00254
(FKBP_C)
4 GLN A  80
PHE A  82
PHE A  87
GLY A 111
None
1.36A 2qmzA-2m2aA:
undetectable
2qmzB-2m2aA:
undetectable
2qmzA-2m2aA:
25.13
2qmzB-2m2aA:
25.13
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.
2nya PERIPLASMIC NITRATE
REDUCTASE


(Escherichia
coli)
PF00384
(Molybdopterin)
PF01568
(Molydop_binding)
PF04879
(Molybdop_Fe4S4)
4 PHE A 508
PHE A 594
TRP A 118
GLY A 379
None
1.41A 2qmzA-2nyaA:
undetectable
2qmzB-2nyaA:
2.1
2qmzA-2nyaA:
15.38
2qmzB-2nyaA:
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.
2pfw CUPIN 2, CONSERVED
BARREL DOMAIN
PROTEIN


(Shewanella
frigidimarina)
PF07883
(Cupin_2)
4 GLN A  55
PHE A 103
PHE A 110
GLY A  46
EDO  A 116 (-3.7A)
None
None
None
1.43A 2qmzA-2pfwA:
undetectable
2qmzB-2pfwA:
undetectable
2qmzA-2pfwA:
19.81
2qmzB-2pfwA:
19.81
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.
2q0f RNA URIDYLYL
TRANSFERASE


(Trypanosoma
brucei)
PF03828
(PAP_assoc)
4 GLN A 257
PHE A 252
PHE A 248
TRP A 293
None
1.36A 2qmzA-2q0fA:
undetectable
2qmzB-2q0fA:
undetectable
2qmzA-2q0fA:
21.92
2qmzB-2q0fA:
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.
2q2r GLUCOKINASE 1,
PUTATIVE


(Trypanosoma
cruzi)
PF02685
(Glucokinase)
4 GLN A 348
PHE A 152
PHE A 148
GLY A 136
None
1.40A 2qmzA-2q2rA:
undetectable
2qmzB-2q2rA:
undetectable
2qmzA-2q2rA:
21.43
2qmzB-2q2rA:
21.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2rt5 MSX2-INTERACTING
PROTEIN


(Homo sapiens)
PF07744
(SPOC)
4 GLN A3627
PHE A3629
PHE A3634
GLY A3562
None
0.72A 2qmzA-2rt5A:
undetectable
2qmzB-2rt5A:
undetectable
2qmzA-2rt5A:
20.64
2qmzB-2rt5A:
20.64
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.
2x0q ALCALIGIN
BIOSYNTHESIS PROTEIN


(Bordetella
bronchiseptica)
PF04183
(IucA_IucC)
PF06276
(FhuF)
4 PHE A 512
PHE A 508
TRP A 531
GLY A 536
None
1.33A 2qmzA-2x0qA:
undetectable
2qmzB-2x0qA:
undetectable
2qmzA-2x0qA:
18.05
2qmzB-2x0qA:
18.05
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.
2xgo XCOGT

(Xanthomonas
campestris)
PF13432
(TPR_16)
PF13844
(Glyco_transf_41)
4 PHE A 287
PHE A 210
TRP A 312
GLY A 553
None
1.43A 2qmzA-2xgoA:
4.1
2qmzB-2xgoA:
4.1
2qmzA-2xgoA:
18.30
2qmzB-2xgoA:
18.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3a3c MALTOSE-BINDING
PERIPLASMIC PROTEIN,
LINKER,
MITOCHONDRIAL
INTERMEMBRANE SPACE
IMPORT AND ASSEMBLY
PROTEIN 40


(Escherichia
coli;
Saccharomyces
cerevisiae;
synthetic
construct)
PF06747
(CHCH)
PF13416
(SBP_bac_8)
4 PHE A 415
PHE A 411
TRP A 394
GLY A 400
None
1.05A 2qmzA-3a3cA:
undetectable
2qmzB-3a3cA:
undetectable
2qmzA-3a3cA:
20.14
2qmzB-3a3cA:
20.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3cmn PUTATIVE HYDROLASE

(Chloroflexus
aurantiacus)
PF10103
(Zincin_2)
4 PHE A 120
PHE A 116
TRP A  46
GLY A 155
None
1.35A 2qmzA-3cmnA:
undetectable
2qmzB-3cmnA:
undetectable
2qmzA-3cmnA:
19.07
2qmzB-3cmnA:
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.
3e20 EUKARYOTIC PEPTIDE
CHAIN RELEASE FACTOR
SUBUNIT 1


(Schizosaccharomyces
pombe)
no annotation 4 GLN C 400
PHE C 288
PHE C 287
GLY C 406
None
1.38A 2qmzA-3e20C:
undetectable
2qmzB-3e20C:
undetectable
2qmzA-3e20C:
20.15
2qmzB-3e20C:
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.
3eqn GLUCAN
1,3-BETA-GLUCOSIDASE


(Phanerochaete
chrysosporium)
PF12708
(Pectate_lyase_3)
4 PHE A 149
PHE A 150
TRP A 570
GLY A 527
None
1.33A 2qmzA-3eqnA:
undetectable
2qmzB-3eqnA:
undetectable
2qmzA-3eqnA:
16.69
2qmzB-3eqnA:
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.
3eqn GLUCAN
1,3-BETA-GLUCOSIDASE


(Phanerochaete
chrysosporium)
PF12708
(Pectate_lyase_3)
4 PHE A 149
PHE A 150
TRP A 570
GLY A 528
None
1.15A 2qmzA-3eqnA:
undetectable
2qmzB-3eqnA:
undetectable
2qmzA-3eqnA:
16.69
2qmzB-3eqnA:
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.
3esf IRON-CONTAINING
SUPEROXIDE DISMUTASE
B2


(Trypanosoma
brucei)
PF00081
(Sod_Fe_N)
PF02777
(Sod_Fe_C)
4 GLN A 194
PHE A  78
PHE A  74
TRP A 127
None
1.03A 2qmzA-3esfA:
undetectable
2qmzB-3esfA:
undetectable
2qmzA-3esfA:
20.50
2qmzB-3esfA:
20.50
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.
3f5b AMINOGLYCOSIDE
N(6')ACETYLTRANSFERA
SE


(Legionella
pneumophila)
PF13523
(Acetyltransf_8)
4 GLN A 111
PHE A  12
PHE A  73
GLY A 105
None
1.22A 2qmzA-3f5bA:
undetectable
2qmzB-3f5bA:
undetectable
2qmzA-3f5bA:
21.94
2qmzB-3f5bA:
21.94
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.
3fca CYSTEINE SYNTHASE

(Thermus
thermophilus)
PF00291
(PALP)
4 GLN A 132
PHE A 133
PHE A 216
GLY A 110
None
1.31A 2qmzA-3fcaA:
undetectable
2qmzB-3fcaA:
undetectable
2qmzA-3fcaA:
21.78
2qmzB-3fcaA:
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.
3fca CYSTEINE SYNTHASE

(Thermus
thermophilus)
PF00291
(PALP)
4 GLN A 132
PHE A 133
PHE A 216
GLY A 113
None
1.40A 2qmzA-3fcaA:
undetectable
2qmzB-3fcaA:
undetectable
2qmzA-3fcaA:
21.78
2qmzB-3fcaA:
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.
3gf6 UNCHARACTERIZED
BACTERIAL
LIPOPROTEIN


(Bacteroides
thetaiotaomicron)
PF12956
(DUF3845)
4 GLN A 119
PHE A 162
PHE A 213
GLY A 112
None
1.28A 2qmzA-3gf6A:
undetectable
2qmzB-3gf6A:
undetectable
2qmzA-3gf6A:
22.64
2qmzB-3gf6A:
22.64
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.
3hxw ALANYL-TRNA
SYNTHETASE


(Escherichia
coli)
PF01411
(tRNA-synt_2c)
4 GLN A  45
PHE A  46
PHE A  98
GLY A  94
None
1.41A 2qmzA-3hxwA:
undetectable
2qmzB-3hxwA:
undetectable
2qmzA-3hxwA:
17.41
2qmzB-3hxwA:
17.41
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.
3i6r DIHYDROOROTATE
DEHYDROGENASE
HOMOLOG,
MITOCHONDRIAL


(Plasmodium
falciparum)
PF01180
(DHO_dh)
4 GLN A 526
PHE A 244
PHE A 217
GLY A 453
None
1.24A 2qmzA-3i6rA:
undetectable
2qmzB-3i6rA:
undetectable
2qmzA-3i6rA:
19.15
2qmzB-3i6rA:
19.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3kxw SAFRAMYCIN MX1
SYNTHETASE B


(Legionella
pneumophila)
PF00501
(AMP-binding)
4 GLN A 171
PHE A 169
PHE A  80
GLY A 220
None
1.23A 2qmzA-3kxwA:
3.3
2qmzB-3kxwA:
3.7
2qmzA-3kxwA:
16.95
2qmzB-3kxwA:
16.95
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.
3kxw SAFRAMYCIN MX1
SYNTHETASE B


(Legionella
pneumophila)
PF00501
(AMP-binding)
4 GLN A 171
PHE A 169
PHE A  80
GLY A 223
None
None
None
1ZZ  A 589 (-3.8A)
1.12A 2qmzA-3kxwA:
3.3
2qmzB-3kxwA:
3.7
2qmzA-3kxwA:
16.95
2qmzB-3kxwA:
16.95
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.
3n7x CAPSID PROTEIN

(Decapod
penstyldensovirus
1)
PF16530
(IHHNV_capsid)
4 GLN A 263
PHE A 265
PHE A 197
GLY A 157
None
1.42A 2qmzA-3n7xA:
undetectable
2qmzB-3n7xA:
undetectable
2qmzA-3n7xA:
21.41
2qmzB-3n7xA:
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.
3npe 9-CIS-EPOXYCAROTENOI
D DIOXYGENASE 1,
CHLOROPLASTIC


(Zea mays)
PF03055
(RPE65)
4 GLN A 202
PHE A 211
PHE A 230
GLY A 237
None
1.37A 2qmzA-3npeA:
undetectable
2qmzB-3npeA:
undetectable
2qmzA-3npeA:
18.70
2qmzB-3npeA:
18.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3oep PUTATIVE
UNCHARACTERIZED
PROTEIN TTHA0988


(Thermus
thermophilus)
PF02626
(CT_A_B)
PF02682
(CT_C_D)
4 GLN A 156
PHE A 125
PHE A 123
GLY A 167
None
GOL  A 501 (-4.8A)
None
GOL  A 501 ( 4.9A)
1.33A 2qmzA-3oepA:
undetectable
2qmzB-3oepA:
undetectable
2qmzA-3oepA:
18.48
2qmzB-3oepA:
18.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3p3l CYTOCHROME P450

(Streptomyces
thioluteus)
PF00067
(p450)
4 GLN A  91
PHE A  89
PHE A  85
GLY A 176
HEM  A 501 (-4.3A)
None
None
None
0.72A 2qmzA-3p3lA:
undetectable
2qmzB-3p3lA:
undetectable
2qmzA-3p3lA:
20.92
2qmzB-3p3lA:
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.
3p8a UNCHARACTERIZED
PROTEIN


(Staphylococcus
aureus)
PF13468
(Glyoxalase_3)
4 GLN A 186
PHE A 189
PHE A 270
GLY A  42
None
1.01A 2qmzA-3p8aA:
undetectable
2qmzB-3p8aA:
undetectable
2qmzA-3p8aA:
19.33
2qmzB-3p8aA:
19.33
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.
3rom ADP-RIBOSYL CYCLASE
1


(Homo sapiens)
PF02267
(Rib_hydrolayse)
4 GLN A 139
PHE A 135
PHE A 284
TRP A 241
None
1.41A 2qmzA-3romA:
5.3
2qmzB-3romA:
5.3
2qmzA-3romA:
21.32
2qmzB-3romA:
21.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ros NAD-DEPENDENT
ALDEHYDE
DEHYDROGENASE


(Lactobacillus
acidophilus)
PF00171
(Aldedh)
4 GLN A 137
PHE A 426
TRP A 418
GLY A 231
None
1.39A 2qmzA-3rosA:
3.3
2qmzB-3rosA:
3.2
2qmzA-3rosA:
18.56
2qmzB-3rosA:
18.56
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.
3t8i PURINE NUCLEOSIDASE,
(IUNH-2)


(Sulfolobus
solfataricus)
PF01156
(IU_nuc_hydro)
4 PHE A  48
PHE A 213
TRP A  87
GLY A  83
None
1.42A 2qmzA-3t8iA:
3.6
2qmzB-3t8iA:
3.6
2qmzA-3t8iA:
22.01
2qmzB-3t8iA:
22.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3tav METHIONINE
AMINOPEPTIDASE


(Mycobacteroides
abscessus)
PF00557
(Peptidase_M24)
4 GLN A 170
PHE A 171
PHE A 175
GLY A 163
None
1.37A 2qmzA-3tavA:
undetectable
2qmzB-3tavA:
undetectable
2qmzA-3tavA:
21.68
2qmzB-3tavA:
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.
3tze TRYPTOPHANYL-TRNA
SYNTHETASE


(Encephalitozoon
cuniculi)
PF00579
(tRNA-synt_1b)
4 GLN A 232
PHE A 202
TRP A 128
GLY A  88
TRP  A 386 (-3.2A)
None
None
TRP  A 386 ( 4.0A)
1.22A 2qmzA-3tzeA:
undetectable
2qmzB-3tzeA:
undetectable
2qmzA-3tzeA:
21.48
2qmzB-3tzeA:
21.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3uw2 PHOSPHOGLUCOMUTASE/P
HOSPHOMANNOMUTASE
FAMILY PROTEIN


(Burkholderia
thailandensis)
PF00408
(PGM_PMM_IV)
PF02878
(PGM_PMM_I)
PF02879
(PGM_PMM_II)
PF02880
(PGM_PMM_III)
4 GLN A 264
PHE A 268
PHE A 333
GLY A 343
None
1.13A 2qmzA-3uw2A:
undetectable
2qmzB-3uw2A:
1.4
2qmzA-3uw2A:
19.50
2qmzB-3uw2A:
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.
3x43 O-UREIDO-L-SERINE
SYNTHASE


(Streptomyces
lavendulae)
PF00291
(PALP)
4 GLN A 142
PHE A 143
PHE A 226
GLY A 123
None
1.36A 2qmzA-3x43A:
undetectable
2qmzB-3x43A:
undetectable
2qmzA-3x43A:
21.16
2qmzB-3x43A:
21.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3x43 O-UREIDO-L-SERINE
SYNTHASE


(Streptomyces
lavendulae)
PF00291
(PALP)
4 GLN A 142
PHE A 143
PHE A 226
GLY A 124
None
1.05A 2qmzA-3x43A:
undetectable
2qmzB-3x43A:
undetectable
2qmzA-3x43A:
21.16
2qmzB-3x43A:
21.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4g10 GLUTATHIONE
S-TRANSFERASE
HOMOLOG


(Sphingomonas
paucimobilis)
PF13417
(GST_N_3)
PF16865
(GST_C_5)
4 PHE A 168
PHE A 164
TRP A 192
GLY A 136
None
1.24A 2qmzA-4g10A:
undetectable
2qmzB-4g10A:
undetectable
2qmzA-4g10A:
20.36
2qmzB-4g10A:
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.
4gl3 PUTATIVE
GLUCOAMYLASE


(Bacteroides
uniformis)
PF10091
(Glycoamylase)
4 PHE A 191
PHE A 192
TRP A 209
GLY A 146
None
0.83A 2qmzA-4gl3A:
undetectable
2qmzB-4gl3A:
undetectable
2qmzA-4gl3A:
18.31
2qmzB-4gl3A:
18.31
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.
4gxb SORTING NEXIN-17

(Homo sapiens)
no annotation 4 GLN A 227
PHE A 175
TRP A 236
GLY A 126
None
None
GOL  A 401 (-3.8A)
None
1.26A 2qmzA-4gxbA:
undetectable
2qmzB-4gxbA:
undetectable
2qmzA-4gxbA:
22.70
2qmzB-4gxbA:
22.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4hhr ALPHA-DIOXYGENASE

(Arabidopsis
thaliana)
PF03098
(An_peroxidase)
4 PHE A 556
PHE A 549
TRP A  47
GLY A 335
None
1.41A 2qmzA-4hhrA:
undetectable
2qmzB-4hhrA:
undetectable
2qmzA-4hhrA:
16.41
2qmzB-4hhrA:
16.41
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.
4jc8 HOPS COMPONENT VPS33

(Chaetomium
thermophilum)
PF00995
(Sec1)
4 GLN A  11
PHE A   7
PHE A 605
GLY A 178
None
1.16A 2qmzA-4jc8A:
4.2
2qmzB-4jc8A:
4.0
2qmzA-4jc8A:
16.87
2qmzB-4jc8A:
16.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4kd6 ENOYL-COA
HYDRATASE/ISOMERASE


(Paraburkholderia
graminis)
PF00378
(ECH_1)
4 GLN A 113
PHE A 220
TRP A 145
GLY A 227
None
1.08A 2qmzA-4kd6A:
undetectable
2qmzB-4kd6A:
undetectable
2qmzA-4kd6A:
23.73
2qmzB-4kd6A:
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.
4kma GM14141P

(Drosophila
melanogaster)
PF05076
(SUFU)
PF12470
(SUFU_C)
4 GLN A 206
PHE A 241
PHE A 218
GLY A 212
None
1.39A 2qmzA-4kmaA:
undetectable
2qmzB-4kmaA:
undetectable
2qmzA-4kmaA:
17.76
2qmzB-4kmaA:
17.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4lq1 1,4-ALPHA-GLUCAN
BRANCHING ENZYME
GLGB


(Escherichia
coli)
PF00128
(Alpha-amylase)
PF02806
(Alpha-amylase_C)
PF02922
(CBM_48)
4 PHE A 560
PHE A 641
TRP A 628
GLY A 625
None
1.35A 2qmzA-4lq1A:
undetectable
2qmzB-4lq1A:
undetectable
2qmzA-4lq1A:
18.49
2qmzB-4lq1A:
18.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4o9x TCDB2, TCCC3

(Photorhabdus
luminescens)
PF03534
(SpvB)
PF12255
(TcdB_toxin_midC)
PF12256
(TcdB_toxin_midN)
4 GLN A1388
PHE A1379
TRP A1444
GLY A1405
None
1.31A 2qmzA-4o9xA:
undetectable
2qmzB-4o9xA:
undetectable
2qmzA-4o9xA:
7.30
2qmzB-4o9xA:
7.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4oht SUCCINATE-SEMIALDEHY
DE DEHYDROGENASE


(Streptococcus
pyogenes)
PF00171
(Aldedh)
4 GLN A 137
PHE A 426
TRP A 418
GLY A 231
None
1.39A 2qmzA-4ohtA:
3.1
2qmzB-4ohtA:
3.2
2qmzA-4ohtA:
19.57
2qmzB-4ohtA:
19.57
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.
4p47 TRAP DICARBOXYLATE
TRANSPORTER, DCTP
SUBUNIT


(Ochrobactrum
anthropi)
PF03480
(DctP)
4 PHE A  34
PHE A  51
TRP A 147
GLY A 143
None
1.43A 2qmzA-4p47A:
undetectable
2qmzB-4p47A:
2.4
2qmzA-4p47A:
21.59
2qmzB-4p47A:
21.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ppy PUTATIVE
ACYLHYDROLASE


(Bacteroides
fragilis)
PF13472
(Lipase_GDSL_2)
4 GLN A 227
PHE A  56
TRP A  65
GLY A  77
None
1.22A 2qmzA-4ppyA:
3.9
2qmzB-4ppyA:
3.9
2qmzA-4ppyA:
21.40
2qmzB-4ppyA:
21.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4tz5 PUTATIVE SECRETED
PROTEIN


(Streptomyces
sp. SirexAA-E)
no annotation 4 GLN A 150
PHE A 152
TRP A 444
GLY A 421
BGC  A 707 ( 4.6A)
BGC  A 707 (-4.9A)
None
None
0.94A 2qmzA-4tz5A:
undetectable
2qmzB-4tz5A:
undetectable
2qmzA-4tz5A:
17.43
2qmzB-4tz5A:
17.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4u8u GLOBIN B CHAIN

(Glossoscolex
paulistus)
PF00042
(Globin)
4 GLN B 119
PHE B  28
TRP B  15
GLY B  22
None
1.20A 2qmzA-4u8uB:
undetectable
2qmzB-4u8uB:
undetectable
2qmzA-4u8uB:
22.13
2qmzB-4u8uB:
22.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4uw9 BETA-PHOSPHOGLUCOMUT
ASE


(Pyrococcus sp.
ST04)
PF13419
(HAD_2)
4 PHE A 104
PHE A 213
TRP A   6
GLY A 196
None
1.38A 2qmzA-4uw9A:
3.3
2qmzB-4uw9A:
3.0
2qmzA-4uw9A:
20.16
2qmzB-4uw9A:
20.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4xkb YCF53-LIKE PROTEIN

(Synechocystis
sp. PCC 6803)
PF05419
(GUN4)
PF16416
(GUN4_N)
4 GLN A 103
PHE A 105
PHE A 158
TRP A 150
None
1.33A 2qmzA-4xkbA:
undetectable
2qmzB-4xkbA:
undetectable
2qmzA-4xkbA:
19.84
2qmzB-4xkbA:
19.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4xkb YCF53-LIKE PROTEIN

(Synechocystis
sp. PCC 6803)
PF05419
(GUN4)
PF16416
(GUN4_N)
4 GLN A 103
PHE A 105
TRP A 150
GLY A 156
None
1.05A 2qmzA-4xkbA:
undetectable
2qmzB-4xkbA:
undetectable
2qmzA-4xkbA:
19.84
2qmzB-4xkbA:
19.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4xnu INTEGRAL MEMBRANE
PROTEIN-DOPAMINE
TRANSPORTER


(Drosophila
melanogaster)
PF00209
(SNF)
4 PHE A 134
PHE A 411
TRP A 145
GLY A 387
None
1.42A 2qmzA-4xnuA:
undetectable
2qmzB-4xnuA:
undetectable
2qmzA-4xnuA:
18.75
2qmzB-4xnuA:
18.75
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.
4xnu INTEGRAL MEMBRANE
PROTEIN-DOPAMINE
TRANSPORTER


(Drosophila
melanogaster)
PF00209
(SNF)
4 PHE A 468
PHE A 471
TRP A 130
GLY A 385
None
1.36A 2qmzA-4xnuA:
undetectable
2qmzB-4xnuA:
undetectable
2qmzA-4xnuA:
18.75
2qmzB-4xnuA:
18.75
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.
4xox 3-OXOACYL-ACP
SYNTHASE


(Vibrio cholerae)
PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C)
4 GLN A 195
PHE A 199
PHE A 227
GLY A 231
None
1.44A 2qmzA-4xoxA:
undetectable
2qmzB-4xoxA:
undetectable
2qmzA-4xoxA:
20.60
2qmzB-4xoxA:
20.60
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.
4yhx RIBOSOMAL PROTEIN
3/HOMING
ENDONUCLEASE-LIKE
FUSION PROTEIN


(Grosmannia
penicillata)
PF00961
(LAGLIDADG_1)
4 PHE A  42
PHE A  91
TRP A  61
GLY A  14
None
1.26A 2qmzA-4yhxA:
undetectable
2qmzB-4yhxA:
undetectable
2qmzA-4yhxA:
21.02
2qmzB-4yhxA:
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.
5d4w PUTATIVE HEAT SHOCK
PROTEIN


(Chaetomium
thermophilum)
PF00004
(AAA)
PF07724
(AAA_2)
PF10431
(ClpB_D2-small)
4 GLN A 690
PHE A 661
PHE A 705
GLY A 677
None
1.20A 2qmzA-5d4wA:
undetectable
2qmzB-5d4wA:
undetectable
2qmzA-5d4wA:
12.75
2qmzB-5d4wA:
12.75
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.
5dwz 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 3


(Pseudomonas
aeruginosa)
PF08541
(ACP_syn_III_C)
PF08545
(ACP_syn_III)
4 GLN C 289
PHE C 266
PHE C 268
GLY C 282
None
1.44A 2qmzA-5dwzC:
undetectable
2qmzB-5dwzC:
undetectable
2qmzA-5dwzC:
22.77
2qmzB-5dwzC:
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.
5e7q ACYL-COA SYNTHETASE

(Streptomyces
platensis)
PF00501
(AMP-binding)
PF13193
(AMP-binding_C)
4 GLN A 220
PHE A 221
PHE A 300
GLY A 310
None
SO4  A 709 (-4.7A)
SO4  A 709 (-4.8A)
None
1.24A 2qmzA-5e7qA:
undetectable
2qmzB-5e7qA:
3.9
2qmzA-5e7qA:
20.44
2qmzB-5e7qA:
20.44
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.
5hf4 DISKS LARGE HOMOLOG
4


(Rattus
norvegicus)
PF00595
(PDZ)
4 GLN A 358
PHE A 337
PHE A 400
GLY A 333
None
1.23A 2qmzA-5hf4A:
undetectable
2qmzB-5hf4A:
undetectable
2qmzA-5hf4A:
21.83
2qmzB-5hf4A:
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.
5jm0 ALPHA-MANNOSIDASE,AL
PHA-MANNOSIDASE,ALPH
A-MANNOSIDASE


(Saccharomyces
cerevisiae)
PF01074
(Glyco_hydro_38)
PF07748
(Glyco_hydro_38C)
PF09261
(Alpha-mann_mid)
4 GLN A 337
PHE A 333
TRP A 318
GLY A 506
None
1.36A 2qmzA-5jm0A:
undetectable
2qmzB-5jm0A:
undetectable
2qmzA-5jm0A:
11.32
2qmzB-5jm0A:
11.32
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.
5m60 BETA-1,3-GLUCANASE

(Chaetomium
thermophilum)
PF12708
(Pectate_lyase_3)
4 PHE A 162
PHE A 163
TRP A 590
GLY A 543
BGC  A 901 (-4.9A)
None
None
None
1.40A 2qmzA-5m60A:
undetectable
2qmzB-5m60A:
undetectable
2qmzA-5m60A:
15.38
2qmzB-5m60A:
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.
5m60 BETA-1,3-GLUCANASE

(Chaetomium
thermophilum)
PF12708
(Pectate_lyase_3)
4 PHE A 162
PHE A 163
TRP A 590
GLY A 544
BGC  A 901 (-4.9A)
None
None
None
1.37A 2qmzA-5m60A:
undetectable
2qmzB-5m60A:
undetectable
2qmzA-5m60A:
15.38
2qmzB-5m60A:
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.
5mvd DIHYDROOROTATE
DEHYDROGENASE
(QUINONE),
MITOCHONDRIAL


(Homo sapiens)
PF01180
(DHO_dh)
4 GLN A 354
PHE A 115
PHE A  88
GLY A 279
None
1.20A 2qmzA-5mvdA:
undetectable
2qmzB-5mvdA:
undetectable
2qmzA-5mvdA:
20.81
2qmzB-5mvdA:
20.81
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.
5ngd PORTAL PROTEIN

(Thermus virus
P74-26)
no annotation 4 GLN A 105
PHE A 101
TRP A 365
GLY A 146
None
1.20A 2qmzA-5ngdA:
undetectable
2qmzB-5ngdA:
undetectable
2qmzA-5ngdA:
18.03
2qmzB-5ngdA:
18.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5t2n I-ONUI_E-AG007820

(synthetic
construct)
PF00961
(LAGLIDADG_1)
4 PHE A  45
PHE A  94
TRP A  64
GLY A  17
None
1.29A 2qmzA-5t2nA:
undetectable
2qmzB-5t2nA:
undetectable
2qmzA-5t2nA:
22.80
2qmzB-5t2nA:
22.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ue7 PHOSPHOMANNOMUTASE

(Candida
albicans)
PF03332
(PMM)
4 GLN A  56
PHE A  47
PHE A  68
GLY A  61
None
1.43A 2qmzA-5ue7A:
undetectable
2qmzB-5ue7A:
undetectable
2qmzA-5ue7A:
22.99
2qmzB-5ue7A:
22.99
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.
5wlh LBACAS13A H328A
(C2C2)


(Lachnospiraceae
bacterium
NK4A179)
no annotation 4 GLN A 914
PHE A 505
PHE A1249
GLY A1045
IOD  A1509 ( 4.7A)
None
None
None
1.42A 2qmzA-5wlhA:
undetectable
2qmzB-5wlhA:
undetectable
2qmzA-5wlhA:
10.07
2qmzB-5wlhA:
10.07
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.
5wvo DNA
(CYTOSINE-5)-METHYLT
RANSFERASE 1


(Homo sapiens)
no annotation 4 GLN C 503
PHE C 499
PHE C 410
GLY C 478
None
1.44A 2qmzA-5wvoC:
undetectable
2qmzB-5wvoC:
undetectable
2qmzA-5wvoC:
22.59
2qmzB-5wvoC:
22.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5xu5 ENDO-1,4-BETA-MANNAN
ASE


(Rhizopus
microsporus)
no annotation 4 GLN B  71
PHE B  72
TRP B  62
GLY B  56
None
1.42A 2qmzA-5xu5B:
undetectable
2qmzB-5xu5B:
undetectable
2qmzA-5xu5B:
17.26
2qmzB-5xu5B:
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.
6cpl HLA CLASS II
HISTOCOMPATIBILITY
ANTIGEN, DR ALPHA
CHAIN


(Homo sapiens)
no annotation 4 GLN A   9
PHE A  24
PHE A  32
GLY A  58
None
1.21A 2qmzA-6cplA:
undetectable
2qmzB-6cplA:
undetectable
2qmzA-6cplA:
15.91
2qmzB-6cplA:
15.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6egt GLYCOPROTEIN

(Rift Valley
fever
phlebovirus)
no annotation 4 PHE A 990
PHE A 903
TRP A 855
GLY A 899
None
1.36A 2qmzA-6egtA:
undetectable
2qmzB-6egtA:
undetectable
2qmzA-6egtA:
16.38
2qmzB-6egtA:
16.38
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.
6fb3 TENEURIN-2

(Gallus gallus)
no annotation 4 PHE A2532
PHE A2453
TRP A2465
GLY A2423
None
0.79A 2qmzA-6fb3A:
undetectable
2qmzB-6fb3A:
undetectable
2qmzA-6fb3A:
19.56
2qmzB-6fb3A:
19.56
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.
6fvs CYS-LOOP
LIGAND-GATED ION
CHANNEL


(endosymbiont of
Tevnia
jerichonana)
no annotation 4 GLN A  25
PHE A 117
PHE A 129
GLY A  22
None
1.40A 2qmzA-6fvsA:
undetectable
2qmzB-6fvsA:
undetectable
2qmzA-6fvsA:
14.35
2qmzB-6fvsA:
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.
6g42 MINOR CAPSID PROTEIN

(Cafeteriavirus-dependent
mavirus)
no annotation 4 GLN A 186
PHE A 165
PHE A 154
GLY A 106
None
1.05A 2qmzA-6g42A:
undetectable
2qmzB-6g42A:
undetectable
2qmzA-6g42A:
17.24
2qmzB-6g42A:
17.24