SIMILAR PATTERNS OF AMINO ACIDS FOR 2DCF_A_ACAA501

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.
1aor ALDEHYDE FERREDOXIN
OXIDOREDUCTASE

(Pyrococcus
furiosus) 		PF01314
(AFOR_C)
PF02730
(AFOR_N) 		4 TYR A 452
TYR A 312
ILE A 249
ILE A 454
 None
 1.24A 2dcfA-1aorA:
0.0		 2dcfA-1aorA:
23.16
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.
1cbg CYANOGENIC
BETA-GLUCOSIDASE

(Trifolium
repens) 		PF00232
(Glyco_hydro_1) 		4 ALA A 365
TYR A 422
TRP A 369
ILE A 372
 None
 1.18A 2dcfA-1cbgA:
0.0		 2dcfA-1cbgA:
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.
1eys PHOTOSYNTHETIC
REACTION CENTER

(Thermochromatium
tepidum) 		PF00124
(Photo_RC) 		4 ALA L 101
TYR L 156
ILE L  99
ILE L  97
 BPH  L 606 ( 3.9A)
BPH  L 606 (-3.7A)
None
None
 0.96A 2dcfA-1eysL:
0.0		 2dcfA-1eysL:
22.41
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.
1eys PHOTOSYNTHETIC
REACTION CENTER

(Thermochromatium
tepidum) 		PF00124
(Photo_RC) 		4 ALA L 101
TYR L 156
TYR L 136
ILE L  97
 BPH  L 606 ( 3.9A)
BPH  L 606 (-3.7A)
BCL  L 604 ( 4.4A)
None
 1.28A 2dcfA-1eysL:
0.0		 2dcfA-1eysL:
22.41
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.
1inp INOSITOL
POLYPHOSPHATE
1-PHOSPHATASE

(Bos taurus) 		PF00459
(Inositol_P) 		4 ALA A  53
TYR A 161
ILE A  18
ILE A 155
 None
 1.15A 2dcfA-1inpA:
0.0		 2dcfA-1inpA:
22.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1jv1 GLCNAC1P
URIDYLTRANSFERASE
ISOFORM 1: AGX1

(Homo sapiens) 		PF01704
(UDPGP) 		4 ALA A 260
TYR A 472
ILE A 143
ILE A  98
 None
 1.15A 2dcfA-1jv1A:
0.0		 2dcfA-1jv1A:
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.
1kcw CERULOPLASMIN

(Homo sapiens) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 ALA A  80
TYR A   5
ILE A 105
ILE A  78
 None
 1.22A 2dcfA-1kcwA:
0.0		 2dcfA-1kcwA:
15.85
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.
1nkq HYPOTHETICAL 28.8
KDA PROTEIN IN
PSD1-SKO1 INTERGENIC
REGION

(Saccharomyces
cerevisiae) 		PF01557
(FAA_hydrolase) 		4 ALA A  91
TYR A   5
ILE A 212
ILE A  93
 None
 0.95A 2dcfA-1nkqA:
undetectable		 2dcfA-1nkqA:
20.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1o4s ASPARTATE
AMINOTRANSFERASE

(Thermotoga
maritima) 		PF00155
(Aminotran_1_2) 		4 TYR A 245
TYR A 228
ILE A  87
ILE A  75
 None
 1.25A 2dcfA-1o4sA:
0.0		 2dcfA-1o4sA:
21.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1oh3 NON-CATALYTIC
PROTEIN 1

(Piromyces equi) 		no annotation 4 ALA A  36
TYR A  97
ILE A 127
ILE A  38
 None
 0.98A 2dcfA-1oh3A:
0.0		 2dcfA-1oh3A:
16.58
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.
1onk GALACTOSE SPECIFIC
LECTIN I B CHAIN

(Viscum album) 		PF00652
(Ricin_B_lectin) 		4 ALA B 233
TRP B 259
ILE B 225
ILE B 248
 None
 1.06A 2dcfA-1onkB:
undetectable		 2dcfA-1onkB:
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.
1rhc F420-DEPENDENT
ALCOHOL
DEHYDROGENASE

(Methanoculleus
thermophilus) 		PF00296
(Bac_luciferase) 		4 TYR A   7
TYR A 230
ILE A 320
ILE A 318
 None
 1.24A 2dcfA-1rhcA:
undetectable		 2dcfA-1rhcA:
21.04
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.
1xmj CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR

(Homo sapiens) 		PF00005
(ABC_tran)
PF14396
(CFTR_R) 		4 ALA A 559
TYR A 517
ILE A 556
ILE A 521
 None
 1.24A 2dcfA-1xmjA:
undetectable		 2dcfA-1xmjA:
21.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1y7e PROBABLE M18-FAMILY
AMINOPEPTIDASE 1

(Borreliella
burgdorferi) 		PF02127
(Peptidase_M18) 		4 ALA A 251
TYR A  25
ILE A 439
ILE A 249
 None
 1.25A 2dcfA-1y7eA:
undetectable		 2dcfA-1y7eA:
20.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2avn UBIQUINONE/MENAQUINO
NE BIOSYNTHESIS
METHYLTRANSFERASE-RE
LATED PROTEIN

(Thermotoga
maritima) 		PF08241
(Methyltransf_11) 		4 ALA A 235
TRP A 233
ILE A 232
ILE A 201
 None
 1.12A 2dcfA-2avnA:
undetectable		 2dcfA-2avnA:
21.46
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.
2bpq ANTHRANILATE
PHOSPHORIBOSYLTRANSF
ERASE

(Mycobacterium
tuberculosis) 		PF00591
(Glycos_transf_3)
PF02885
(Glycos_trans_3N) 		4 ALA A  66
TYR A 186
ILE A 196
ILE A  62
 None
 0.97A 2dcfA-2bpqA:
undetectable		 2dcfA-2bpqA:
24.42
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.
2c5q RRAA-LIKE PROTEIN
YER010C

(Saccharomyces
cerevisiae) 		PF03737
(RraA-like) 		4 ALA A 107
TYR A  66
TYR A  99
ILE A  67
 None
 1.06A 2dcfA-2c5qA:
undetectable		 2dcfA-2c5qA:
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.
2ede NETRIN RECEPTOR DCC

(Homo sapiens) 		PF00041
(fn3) 		4 ALA A  88
TRP A  31
ILE A  86
ILE A  45
 None
 1.19A 2dcfA-2edeA:
undetectable		 2dcfA-2edeA:
14.17
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.
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis) 		PF00106
(adh_short) 		4 ALA A 496
TYR A 459
ILE A 494
ILE A 458
 None
 1.27A 2dcfA-2et6A:
undetectable		 2dcfA-2et6A:
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.
2ghi TRANSPORT PROTEIN

(Plasmodium
yoelii) 		PF00005
(ABC_tran) 		4 ALA A 220
TYR A 247
ILE A 209
ILE A 223
 None
 1.26A 2dcfA-2ghiA:
undetectable		 2dcfA-2ghiA:
19.49
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.
2glf PROBABLE M18-FAMILY
AMINOPEPTIDASE 1

(Thermotoga
maritima) 		PF02127
(Peptidase_M18) 		4 ALA A 247
TYR A  25
ILE A 432
ILE A 245
 None
 1.15A 2dcfA-2glfA:
undetectable		 2dcfA-2glfA:
23.01
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.
2gou OXIDOREDUCTASE,
FMN-BINDING

(Shewanella
oneidensis) 		PF00724
(Oxidored_FMN) 		4 ALA A 316
TYR A 302
ILE A 297
ILE A 319
 None
 0.91A 2dcfA-2gouA:
undetectable		 2dcfA-2gouA:
23.57
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.
2h2q BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE

(Trypanosoma
cruzi) 		PF00186
(DHFR_1)
PF00303
(Thymidylat_synt) 		4 ALA A  28
TYR A 160
ILE A  41
ILE A  35
 NAP  A 523 (-3.7A)
None
NAP  A 523 (-4.4A)
NAP  A 523 (-3.8A)
 1.09A 2dcfA-2h2qA:
undetectable		 2dcfA-2h2qA:
23.22
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.
2inc TOLUENE, O-XYLENE
MONOOXYGENASE
OXYGENASE SUBUNIT

(Pseudomonas
stutzeri) 		PF02332
(Phenol_Hydrox)
PF04945
(YHS) 		4 ALA A 172
TYR B  37
ILE A 170
ILE A 162
 None
 1.26A 2dcfA-2incA:
undetectable		 2dcfA-2incA:
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.
2ipc PREPROTEIN
TRANSLOCASE SECA
SUBUNIT

(Thermus
thermophilus) 		PF01043
(SecA_PP_bind)
PF07516
(SecA_SW)
PF07517
(SecA_DEAD) 		4 ALA A 219
TYR A 399
ILE A 216
ILE A 214
 None
 0.90A 2dcfA-2ipcA:
undetectable		 2dcfA-2ipcA:
17.49
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.
2lle CHEMOTAXIS PROTEIN
CHEY, IMIDAZOLE
GLYCEROL PHOSPHATE
SYNTHASE SUBUNIT
HISF CHIMERA

(Thermotoga
maritima) 		PF00072
(Response_reg)
PF00977
(His_biosynth) 		4 ALA A  54
TYR A  21
ILE A  28
ILE A  56
 None
 0.98A 2dcfA-2lleA:
undetectable		 2dcfA-2lleA:
19.54
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.
2n4x CYTOCHROME C-TYPE
BIOGENESIS PROTEIN
(CCDA)

(Archaeoglobus
fulgidus) 		no annotation 4 ALA A 123
TYR A 142
ILE A 125
ILE A 127
 None
 1.16A 2dcfA-2n4xA:
undetectable		 2dcfA-2n4xA:
20.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2np0 BOTULINUM NEUROTOXIN
TYPE B

(Clostridium
botulinum) 		PF01742
(Peptidase_M27)
PF07951
(Toxin_R_bind_C)
PF07952
(Toxin_trans)
PF07953
(Toxin_R_bind_N) 		4 ALA A 766
TYR A 622
ILE A 770
ILE A 763
 None
 1.27A 2dcfA-2np0A:
undetectable		 2dcfA-2np0A:
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.
2po4 VIRION RNA
POLYMERASE

(Escherichia
virus N4) 		no annotation 4 ALA A1011
TYR A 987
ILE A1025
ILE A 822
 None
 1.13A 2dcfA-2po4A:
undetectable		 2dcfA-2po4A:
18.27
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.
2pzf CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR

(Homo sapiens) 		PF00005
(ABC_tran) 		4 ALA A 559
TYR A 517
ILE A 556
ILE A 521
 None
 1.25A 2dcfA-2pzfA:
undetectable		 2dcfA-2pzfA:
18.73
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.
2qk7 GAMMA-HEMOLYSIN
COMPONENT A

(Staphylococcus
aureus) 		PF07968
(Leukocidin) 		4 ALA A  45
TYR A 111
TYR A  41
ILE A  92
 None
 1.26A 2dcfA-2qk7A:
undetectable		 2dcfA-2qk7A:
18.93
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.
2r8w AGR_C_1641P

(Agrobacterium
fabrum) 		PF00701
(DHDPS) 		4 ALA A 192
TYR A 240
ILE A 220
ILE A 165
 None
 1.13A 2dcfA-2r8wA:
undetectable		 2dcfA-2r8wA:
25.67
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.
2yqh UDP-N-ACETYLGLUCOSAM
INE
PYROPHOSPHORYLASE

(Candida
albicans) 		PF01704
(UDPGP) 		4 ALA A 264
TYR A 467
ILE A 144
ILE A  99
 None
 1.11A 2dcfA-2yqhA:
undetectable		 2dcfA-2yqhA:
19.55
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.
2yvu PROBABLE
ADENYLYL-SULFATE
KINASE

(Aeropyrum
pernix) 		PF01583
(APS_kinase) 		4 ALA A  78
TRP A  76
ILE A 106
ILE A 112
 None
 1.12A 2dcfA-2yvuA:
undetectable		 2dcfA-2yvuA:
18.69
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2zm2 6-AMINOHEXANOATE-DIM
ER HYDROLASE

(Flavobacterium
sp.) 		PF00144
(Beta-lactamase) 		4 TYR A 215
TRP A 331
ILE A 343
ILE A 345
 GOL  A 505 ( 4.4A)
MES  A 501 (-4.0A)
MES  A 501 (-4.2A)
MES  A 504 ( 3.7A)
 0.22A 2dcfA-2zm2A:
67.4		 2dcfA-2zm2A:
97.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3aqk POLY(A) POLYMERASE

(Escherichia
coli) 		PF01743
(PolyA_pol)
PF12626
(PolyA_pol_arg_C)
PF12627
(PolyA_pol_RNAbd) 		4 ALA A 201
TYR A 191
ILE A 212
ILE A 220
 None
 1.08A 2dcfA-3aqkA:
undetectable		 2dcfA-3aqkA:
20.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ayn RHODOPSIN

(Todarodes
pacificus) 		PF00001
(7tm_1) 		4 ALA A 167
TYR A 177
ILE A 168
ILE A 117
 None
 1.20A 2dcfA-3aynA:
undetectable		 2dcfA-3aynA:
19.59
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.
3c1o EUGENOL SYNTHASE

(Clarkia breweri) 		PF05368
(NmrA) 		4 ALA A  96
TYR A   7
ILE A 103
ILE A  93
 None
 1.18A 2dcfA-3c1oA:
undetectable		 2dcfA-3c1oA:
17.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3dqp OXIDOREDUCTASE YLBE

(Lactococcus
lactis) 		PF13460
(NAD_binding_10) 		4 ALA A  66
TYR A  25
ILE A 102
ILE A   3
 None
 1.19A 2dcfA-3dqpA:
undetectable		 2dcfA-3dqpA:
19.59
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.
3ecf NTF2-LIKE PROTEIN

(Trichormus
variabilis) 		PF16247
(DUF4904) 		4 ALA A 119
TYR A  88
TRP A 123
ILE A 121
 None
 1.28A 2dcfA-3ecfA:
undetectable		 2dcfA-3ecfA:
13.51
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.
3eef N-CARBAMOYLSARCOSINE
AMIDASE RELATED
PROTEIN

(Thermoplasma
acidophilum) 		PF00857
(Isochorismatase) 		4 ALA A 107
TYR A  86
ILE A 110
ILE A 104
 None
 1.00A 2dcfA-3eefA:
undetectable		 2dcfA-3eefA:
20.10
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.
3few COLICIN S4

(Escherichia
coli) 		PF01024
(Colicin) 		4 ALA X 475
TYR X 329
ILE X 317
ILE X 336
 None
 1.27A 2dcfA-3fewX:
undetectable		 2dcfA-3fewX:
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.
3g68 PUTATIVE
PHOSPHOSUGAR
ISOMERASE

(Clostridioides
difficile) 		PF01380
(SIS) 		4 ALA A 252
TYR A 240
ILE A 253
ILE A 249
 None
 1.21A 2dcfA-3g68A:
undetectable		 2dcfA-3g68A:
20.80
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.
3hmj FATTY ACID SYNTHASE
SUBUNIT ALPHA

(Saccharomyces
cerevisiae) 		PF00109
(ketoacyl-synt)
PF01648
(ACPS)
PF02801
(Ketoacyl-synt_C) 		4 ALA A1390
TYR A1529
ILE A1019
ILE A1403
 None
 0.94A 2dcfA-3hmjA:
undetectable		 2dcfA-3hmjA:
11.18
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.
3hol TBPB

(Actinobacillus
pleuropneumoniae) 		PF01298
(TbpB_B_D)
PF17483
(TbpB_C)
PF17484
(TbpB_A) 		4 ALA A  46
TYR A 258
TYR A 124
ILE A  71
 None
 0.97A 2dcfA-3holA:
undetectable		 2dcfA-3holA:
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.
3hsy GLUTAMATE RECEPTOR 2

(Rattus
norvegicus) 		PF01094
(ANF_receptor) 		4 ALA A 217
TYR A 129
ILE A 216
ILE A 187
 None
 1.22A 2dcfA-3hsyA:
undetectable		 2dcfA-3hsyA:
23.09
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.
3hzh CHEMOTAXIS OPERON
PROTEIN (CHEX)

(Borreliella
burgdorferi) 		PF13690
(CheX) 		4 ALA B 138
TYR B   5
ILE B 140
ILE B 155
 None
 1.26A 2dcfA-3hzhB:
undetectable		 2dcfA-3hzhB:
18.32
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.
3k30 HISTAMINE
DEHYDROGENASE

(Pimelobacter
simplex) 		PF00724
(Oxidored_FMN)
PF07992
(Pyr_redox_2) 		4 ALA A  75
TYR A  40
ILE A  74
ILE A  78
 None
 1.15A 2dcfA-3k30A:
undetectable		 2dcfA-3k30A:
20.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3lew SUSD-LIKE
CARBOHYDRATE BINDING
PROTEIN

(Bacteroides
vulgatus) 		PF07980
(SusD_RagB)
PF14322
(SusD-like_3) 		4 ALA A 170
TYR A 150
TYR A 112
ILE A 172
 None
None
1PE  A   5 (-3.6A)
None
 1.16A 2dcfA-3lewA:
undetectable		 2dcfA-3lewA:
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.
3mse CALCIUM-DEPENDENT
PROTEIN KINASE,
PUTATIVE

(Plasmodium
falciparum) 		PF10591
(SPARC_Ca_bdg)
PF13202
(EF-hand_5) 		4 ALA B  27
TYR B  12
ILE B  25
ILE B  23
 None
 1.05A 2dcfA-3mseB:
undetectable		 2dcfA-3mseB:
18.02
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.
3nqk UNCHARACTERIZED
PROTEIN

(Bacteroides
ovatus) 		PF14274
(DUF4361)
PF16343
(DUF4973) 		4 ALA A  37
TYR A  61
ILE A  39
ILE A  49
 None
 1.04A 2dcfA-3nqkA:
undetectable		 2dcfA-3nqkA:
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.
3oc4 OXIDOREDUCTASE,
PYRIDINE
NUCLEOTIDE-DISULFIDE
FAMILY

(Enterococcus
faecalis) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		4 ALA A 108
TYR A 246
ILE A 106
ILE A   6
 None
FAD  A 500 (-4.5A)
None
None
 1.21A 2dcfA-3oc4A:
undetectable		 2dcfA-3oc4A:
23.00
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.
3oyr TRANS-ISOPRENYL
DIPHOSPHATE SYNTHASE

(Caulobacter
vibrioides) 		PF00348
(polyprenyl_synt) 		4 ALA A 283
TYR A 227
ILE A 255
ILE A 287
 None
 0.94A 2dcfA-3oyrA:
undetectable		 2dcfA-3oyrA:
26.28
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.
3rg9 BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE

(Trypanosoma
brucei) 		PF00186
(DHFR_1) 		4 ALA A  34
TYR A 166
ILE A  47
ILE A  41
 WRA  A 602 (-3.9A)
None
WRA  A 602 ( 4.5A)
NDP  A 601 (-3.5A)
 1.02A 2dcfA-3rg9A:
undetectable		 2dcfA-3rg9A:
20.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3roh LEUCOTOXIN LUKEV

(Staphylococcus
aureus) 		PF07968
(Leukocidin) 		4 ALA A  73
TYR A 141
TYR A  69
ILE A 122
 None
 1.19A 2dcfA-3rohA:
undetectable		 2dcfA-3rohA:
19.51
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.
3rys ADENOSINE DEAMINASE
1

(Paenarthrobacter
aurescens) 		PF00962
(A_deaminase) 		4 ALA A 141
TYR A 186
ILE A 139
ILE A 168
 None
 0.99A 2dcfA-3rysA:
undetectable		 2dcfA-3rysA:
24.88
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.
3vns NRPS ADENYLATION
PROTEIN CYTC1

(Streptomyces
sp.) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		4 ALA A 217
TYR A  43
TRP A 215
ILE A 214
 None
 0.98A 2dcfA-3vnsA:
undetectable		 2dcfA-3vnsA:
25.09
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.
3vrc CYTOCHROME C'

(Thermochromatium
tepidum) 		PF01322
(Cytochrom_C_2) 		4 ALA A  73
TYR A  16
TYR A  58
ILE A   9
 HEC  A 200 ( 4.1A)
HEC  A 200 (-3.6A)
None
HEC  A 200 ( 4.7A)
 1.21A 2dcfA-3vrcA:
undetectable		 2dcfA-3vrcA:
16.37
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.
3wfa ALPHA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron) 		PF10566
(Glyco_hydro_97)
PF14508
(GH97_N)
PF14509
(GH97_C) 		4 ALA A 601
TYR A 590
TYR A 607
ILE A 328
 None
 1.15A 2dcfA-3wfaA:
undetectable		 2dcfA-3wfaA:
20.08
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.
3wmt PROBABLE FERULOYL
ESTERASE B-1

(Aspergillus
oryzae) 		PF07519
(Tannase) 		4 ALA A 381
TYR A 361
ILE A 383
ILE A 233
 None
 1.26A 2dcfA-3wmtA:
undetectable		 2dcfA-3wmtA:
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.
4d1d HYDANTOIN TRANSPORT
PROTEIN

(Microbacterium
liquefaciens) 		PF02133
(Transp_cyt_pur) 		4 ALA A  49
TRP A 281
ILE A  47
ILE A  45
 None
 1.10A 2dcfA-4d1dA:
undetectable		 2dcfA-4d1dA:
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.
4dg8 PA1221

(Pseudomonas
aeruginosa) 		PF00501
(AMP-binding) 		4 ALA A 223
TYR A  53
TRP A 221
ILE A 220
 None
 1.15A 2dcfA-4dg8A:
undetectable		 2dcfA-4dg8A:
21.63
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.
4din CAMP-DEPENDENT
PROTEIN KINASE TYPE
I-BETA REGULATORY
SUBUNIT

(Homo sapiens) 		PF00027
(cNMP_binding)
PF02197
(RIIa) 		4 ALA B 150
TYR B 111
ILE B 224
ILE B 232
 None
 1.25A 2dcfA-4dinB:
undetectable		 2dcfA-4dinB:
21.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4dok SIMILARITY TO
CHALCONE-FLAVONONE
ISOMERASE

(Arabidopsis
thaliana) 		PF02431
(Chalcone) 		4 TYR A 185
TYR A 101
ILE A 158
ILE A  88
 None
 1.18A 2dcfA-4dokA:
undetectable		 2dcfA-4dokA:
19.39
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.
4emk U6 SNRNA-ASSOCIATED
SM-LIKE PROTEIN LSM6
U6 SNRNA-ASSOCIATED
SM-LIKE PROTEIN LSM7

(Schizosaccharomyces
pombe) 		PF01423
(LSM) 		4 ALA B  60
TYR B  27
ILE C  96
ILE B  62
 None
 1.15A 2dcfA-4emkB:
undetectable		 2dcfA-4emkB:
11.25
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.
4f4c MULTIDRUG RESISTANCE
PROTEIN PGP-1

(Caenorhabditis
elegans) 		PF00005
(ABC_tran)
PF00664
(ABC_membrane) 		4 ALA A 619
TYR A 646
ILE A 608
ILE A 622
 None
 1.24A 2dcfA-4f4cA:
undetectable		 2dcfA-4f4cA:
15.75
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.
4m7o IRON-BINDING PROTEIN

(Staphylococcus
epidermidis) 		PF01497
(Peripla_BP_2) 		4 ALA A 260
TYR A 245
ILE A 233
ILE A 266
 None
 1.09A 2dcfA-4m7oA:
undetectable		 2dcfA-4m7oA:
20.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ose PUTATIVE HYDROLASE

(Rickettsia
typhi) 		PF00561
(Abhydrolase_1) 		4 ALA A 153
TYR A 173
ILE A 149
ILE A 172
 None
 1.25A 2dcfA-4oseA:
undetectable		 2dcfA-4oseA:
19.41
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.
4psu ALPHA/BETA HYDROLASE

(Rhodopseudomonas
palustris) 		PF12697
(Abhydrolase_6) 		4 ALA A 289
TYR A  67
ILE A 285
ILE A 134
 None
 1.20A 2dcfA-4psuA:
undetectable		 2dcfA-4psuA:
23.31
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.
4r29 UNCHARACTERIZED
PROTEIN

(Escherichia
coli) 		no annotation 4 TYR A  34
TYR A 118
ILE A  26
ILE A  30
 None
 1.22A 2dcfA-4r29A:
undetectable		 2dcfA-4r29A:
18.25
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.
4re2 BETA-MANNOSIDASE/BET
A-GLUCOSIDASE

(Oryza sativa) 		PF00232
(Glyco_hydro_1) 		4 ALA A 357
TYR A 412
TRP A 361
ILE A 364
 None
None
EPE  A 503 ( 3.5A)
None
 1.22A 2dcfA-4re2A:
undetectable		 2dcfA-4re2A:
22.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4udn PERIPLASMIC SOLUTE
BINDING PROTEIN

(Candidatus
Liberibacter
asiaticus) 		PF01297
(ZnuA) 		4 ALA A 114
TYR A 143
TYR A 259
ILE A 118
 None
 0.97A 2dcfA-4udnA:
undetectable		 2dcfA-4udnA:
19.54
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.
4uou FUCOSE-SPECIFIC
LECTIN FLEA

(Aspergillus
fumigatus) 		PF07938
(Fungal_lectin) 		4 ALA A 216
TRP A 179
ILE A 231
ILE A 268
 None
 1.27A 2dcfA-4uouA:
undetectable		 2dcfA-4uouA:
24.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ww3 RHODOPSIN

(Todarodes
pacificus) 		PF00001
(7tm_1) 		4 ALA A 167
TYR A 177
ILE A 168
ILE A 117
 None
 1.23A 2dcfA-4ww3A:
undetectable		 2dcfA-4ww3A:
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.
5aw4 NA+,K+-ATPASE BETA
SUBUNIT

(Squalus
acanthias) 		PF00287
(Na_K-ATPase) 		4 ALA B 216
TYR B 231
ILE B 276
ILE B 229
 None
 1.08A 2dcfA-5aw4B:
undetectable		 2dcfA-5aw4B:
21.21
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.
5cef ASPARTATE-SEMIALDEHY
DE DEHYDROGENASE

(Cryptococcus
neoformans) 		PF01118
(Semialdhyde_dh)
PF02774
(Semialdhyde_dhC) 		4 ALA A 358
TYR A 149
TYR A 109
ILE A 136
 None
 1.17A 2dcfA-5cefA:
undetectable		 2dcfA-5cefA:
22.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ecx DEHYDROFOLATE
REDUCTASE TYPE I

(Klebsiella
pneumoniae) 		PF00186
(DHFR_1) 		4 ALA A   7
TYR A 102
ILE A  20
ILE A  14
 5N1  A 202 ( 3.5A)
None
NAP  A 201 (-4.1A)
NAP  A 201 (-3.9A)
 1.16A 2dcfA-5ecxA:
undetectable		 2dcfA-5ecxA:
15.32
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.
5eo7 PREDICTED PROTEIN

(Aspergillus
oryzae) 		PF07938
(Fungal_lectin) 		4 ALA A 216
TRP A 179
ILE A 231
ILE A 268
 None
 1.28A 2dcfA-5eo7A:
undetectable		 2dcfA-5eo7A:
24.15
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.
5f1z NON-RECEPTOR
TYROSINE-PROTEIN
KINASE TYK2

(Homo sapiens) 		PF07714
(Pkinase_Tyr) 		4 ALA A1047
TYR A1080
ILE A 950
ILE A1020
 None
 1.24A 2dcfA-5f1zA:
undetectable		 2dcfA-5f1zA:
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.
5gz1 MESO-DIAMINOPIMELATE
D-DEHYDROGENASE

(Ureibacillus
thermosphaericus) 		PF01113
(DapB_N)
PF16654
(DAPDH_C) 		4 ALA A 117
TYR A 102
ILE A  90
ILE A 119
 None
 0.88A 2dcfA-5gz1A:
undetectable		 2dcfA-5gz1A:
21.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5hgr ORANGE CAROTENOID
PROTEIN (OCP)

(Nostoc sp. PCC
7120) 		PF02136
(NTF2)
PF09150
(Carot_N) 		4 ALA A   8
TYR A 266
ILE A   5
ILE A   3
 None
 1.23A 2dcfA-5hgrA:
undetectable		 2dcfA-5hgrA:
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.
5hqb ALPHA-GLUCOSIDASE

(Pseudoalteromonas
sp. K8) 		PF10566
(Glyco_hydro_97)
PF14508
(GH97_N)
PF14509
(GH97_C) 		4 ALA A 550
TYR A 539
TYR A 556
ILE A 286
 None
 1.09A 2dcfA-5hqbA:
undetectable		 2dcfA-5hqbA:
19.32
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.
5hzg STRIGOLACTONE
ESTERASE D14

(Arabidopsis
thaliana) 		PF12697
(Abhydrolase_6) 		4 ALA A 106
TYR A  93
ILE A 104
ILE A 102
 None
 1.27A 2dcfA-5hzgA:
undetectable		 2dcfA-5hzgA:
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.
5i2g DIOL DEHYDRATASE

(Roseburia
inulinivorans) 		PF01228
(Gly_radical)
PF02901
(PFL-like) 		4 ALA A 312
TYR A 298
ILE A 316
ILE A   9
 None
 1.19A 2dcfA-5i2gA:
undetectable		 2dcfA-5i2gA:
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.
5j6q CELL WALL BINDING
PROTEIN CWP8

(Clostridioides
difficile) 		PF04122
(CW_binding_2) 		4 ALA A 440
TYR A 515
ILE A 438
ILE A 552
 None
 1.13A 2dcfA-5j6qA:
undetectable		 2dcfA-5j6qA:
22.22
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.
5lki TCDA1

(Photorhabdus
luminescens) 		PF03538
(VRP1) 		4 ALA A2389
TYR A2341
ILE A2507
ILE A2357
 None
 1.18A 2dcfA-5lkiA:
undetectable		 2dcfA-5lkiA:
9.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5n9x ADENYLATION DOMAIN

(Streptomyces
sp.) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		4 ALA A 221
TYR A  46
TRP A 219
ILE A 218
 None
 1.11A 2dcfA-5n9xA:
undetectable		 2dcfA-5n9xA:
23.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5no8 BACCELL_00875

(Bacteroides
cellulosilyticus) 		no annotation 4 ALA A 219
TYR A  70
ILE A 202
ILE A 217
 None
 1.16A 2dcfA-5no8A:
undetectable		 2dcfA-5no8A:
20.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5o5j 30S RIBOSOMAL
PROTEIN S2

(Mycolicibacterium
smegmatis) 		PF00318
(Ribosomal_S2) 		4 ALA V  53
TRP V 162
ILE V 217
ILE V  50
 None
 1.23A 2dcfA-5o5jV:
undetectable		 2dcfA-5o5jV:
22.22
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.
5um8 GLYCOPROTEIN GP120

(Human
immunodeficiency
virus 1) 		PF00516
(GP120) 		4 ALA G 329
TYR G 177
ILE G 443
ILE G 420
 None
 1.14A 2dcfA-5um8G:
undetectable		 2dcfA-5um8G:
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.
5ung CHIMERA PROTEIN OF
TYPE-2 ANGIOTENSIN
II RECEPTOR AND
SOLUBLE CYTOCHROME
B562

(Escherichia
coli;
Homo sapiens) 		PF00001
(7tm_1)
PF07361
(Cytochrom_B562) 		4 ALA B 194
TYR B 103
TRP B 110
ILE B 196
 None
8ES  B1201 (-4.8A)
None
None
 1.21A 2dcfA-5ungB:
undetectable		 2dcfA-5ungB:
21.04
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.
5uyg PERIPLASMIC CHELATED
IRON-BINDING PROTEIN
YFEA

(Yersinia pestis) 		PF01297
(ZnuA) 		4 ALA A 149
TYR A 178
TYR A 294
ILE A 153
 None
 0.96A 2dcfA-5uygA:
undetectable		 2dcfA-5uygA:
20.88
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.
5wwo ESSENTIAL NUCLEAR
PROTEIN 1

(Saccharomyces
cerevisiae) 		PF05291
(Bystin) 		4 ALA A 420
TYR A 393
ILE A 416
ILE A 372
 None
 1.08A 2dcfA-5wwoA:
undetectable		 2dcfA-5wwoA:
23.11
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.
5xj1 UNCHARACTERIZED RNA
METHYLTRANSFERASE
SP_1029

(Streptococcus
pneumoniae) 		no annotation 4 ALA A 400
TYR A 420
ILE A 309
ILE A 403
 None
 1.16A 2dcfA-5xj1A:
undetectable		 2dcfA-5xj1A:
22.04
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.
6b0k IOTA-CARRAGEENAN
SULFATASE

(Pseudoalteromonas) 		no annotation 4 ALA A 385
TYR A  72
ILE A 397
ILE A 383
 None
 1.25A 2dcfA-6b0kA:
undetectable		 2dcfA-6b0kA:
11.17
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.
6cgm RIBONUCLEOSIDE-DIPHO
SPHATE REDUCTASE

(Bacillus
subtilis) 		no annotation 4 ALA A 297
TYR A 323
TYR A 299
ILE A 337
 None
 1.27A 2dcfA-6cgmA:
undetectable		 2dcfA-6cgmA:
8.67
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.
6cxm DIHYDROFOLATE
REDUCTASE

(Mycolicibacterium
smegmatis) 		no annotation 4 ALA A   8
TYR A  98
ILE A  21
ILE A  15
 NAP  A 201 (-3.9A)
None
NAP  A 201 (-3.8A)
NAP  A 201 (-4.1A)
 1.12A 2dcfA-6cxmA:
undetectable		 2dcfA-6cxmA:
11.00
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.
6f4c ALPHA-GALACTOSIDASE

(Nicotiana
benthamiana) 		no annotation 4 ALA B 399
TYR B 409
ILE B 364
ILE B 397
 None
 1.10A 2dcfA-6f4cB:
undetectable		 2dcfA-6f4cB:
12.53
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.
6fai ESSENTIAL NUCLEAR
PROTEIN 1

(Saccharomyces
cerevisiae) 		no annotation 4 ALA i 420
TYR i 393
ILE i 416
ILE i 372
 None
 1.08A 2dcfA-6faii:
undetectable		 2dcfA-6faii:
10.46
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.
6gdg TRXA,ADENOSINE
RECEPTOR A2A

(Escherichia
coli;
Homo sapiens) 		no annotation 4 TYR A 288
TYR A 197
ILE A 100
ILE A  98
 None
 1.16A 2dcfA-6gdgA:
undetectable		 2dcfA-6gdgA:
10.97