SIMILAR PATTERNS OF AMINO ACIDS FOR 2WX2_B_TPFB1460

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.
1b0a PROTEIN (FOLD
BIFUNCTIONAL
PROTEIN)


(Escherichia
coli)
PF00763
(THF_DHG_CYH)
PF02882
(THF_DHG_CYH_C)
4 MET A 175
ALA A 209
THR A 257
LEU A 149
None
1.02A 2wx2B-1b0aA:
undetectable
2wx2B-1b0aA:
20.33
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.
1b7g PROTEIN
(GLYCERALDEHYDE
3-PHOSPHATE
DEHYDROGENASE)


(Sulfolobus
solfataricus)
PF01113
(DapB_N)
PF02800
(Gp_dh_C)
4 TYR O  51
ALA O  40
ALA O  43
LEU O  28
None
1.02A 2wx2B-1b7gO:
undetectable
2wx2B-1b7gO:
22.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ggv DIENELACTONE
HYDROLASE


(Pseudomonas
putida)
PF01738
(DLH)
4 ALA A 216
ALA A 220
THR A 224
LEU A 164
None
0.92A 2wx2B-1ggvA:
undetectable
2wx2B-1ggvA:
18.34
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.
1hl2 N-ACETYLNEURAMINATE
LYASE SUBUNIT


(Escherichia
coli)
PF00701
(DHDPS)
4 PHE A 100
TYR A  98
ALA A  78
THR A  14
None
0.70A 2wx2B-1hl2A:
undetectable
2wx2B-1hl2A:
19.37
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.
1jro XANTHINE
DEHYDROGENASE, CHAIN
A


(Rhodobacter
capsulatus)
PF00111
(Fer2)
PF00941
(FAD_binding_5)
PF01799
(Fer2_2)
PF03450
(CO_deh_flav_C)
4 PHE A 384
ALA A 439
ALA A 443
LEU A 401
None
1.04A 2wx2B-1jroA:
undetectable
2wx2B-1jroA:
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.
1mdw CALPAIN II,
CATALYTIC SUBUNIT


(Rattus
norvegicus)
PF00648
(Peptidase_C2)
4 ALA A 112
ALA A 110
THR A 208
LEU A 343
None
1.04A 2wx2B-1mdwA:
undetectable
2wx2B-1mdwA:
19.92
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.
1mn6 POLYKETIDE SYNTHASE
IV


(Streptomyces
venezuelae)
PF00975
(Thioesterase)
4 TYR A 216
ALA A 151
ALA A 154
LEU A 126
None
0.96A 2wx2B-1mn6A:
undetectable
2wx2B-1mn6A:
20.04
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.
1nio B-LUFFIN

(Luffa
aegyptiaca)
PF00161
(RIP)
4 TYR A  82
TYR A  75
ALA A 150
ALA A 146
None
0.84A 2wx2B-1nioA:
undetectable
2wx2B-1nioA:
18.43
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.
1nr6 CYTOCHROME P450 2C5

(Oryctolagus
cuniculus)
PF00067
(p450)
4 PHE A 114
ALA A 294
THR A 298
LEU A 359
DIF  A 501 (-4.5A)
DIF  A 501 ( 3.3A)
HEM  A 500 ( 3.6A)
DIF  A 501 (-4.4A)
0.81A 2wx2B-1nr6A:
31.5
2wx2B-1nr6A:
26.09
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.
1s4o GLYCOLIPID
2-ALPHA-MANNOSYLTRAN
SFERASE


(Saccharomyces
cerevisiae)
PF01793
(Glyco_transf_15)
4 TYR A 319
ALA A 370
ALA A 368
LEU A 348
None
0.98A 2wx2B-1s4oA:
undetectable
2wx2B-1s4oA:
20.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1soi MUTT/NUDIX FAMILY
PROTEIN


(Deinococcus
radiodurans)
PF00293
(NUDIX)
4 ALA A  62
ALA A  66
THR A  70
LEU A  28
None
0.93A 2wx2B-1soiA:
undetectable
2wx2B-1soiA:
16.03
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.
1t3q QUINOLINE
2-OXIDOREDUCTASE
MEDIUM SUBUNIT


(Pseudomonas
putida)
PF00941
(FAD_binding_5)
PF03450
(CO_deh_flav_C)
4 ALA C 240
ALA C 244
THR C 248
LEU C 213
None
0.56A 2wx2B-1t3qC:
undetectable
2wx2B-1t3qC:
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.
1tsj CONSERVED
HYPOTHETICAL PROTEIN


(Staphylococcus
aureus)
PF06983
(3-dmu-9_3-mt)
4 PHE A  12
ALA A  16
THR A  24
LEU A  56
None
0.84A 2wx2B-1tsjA:
undetectable
2wx2B-1tsjA:
14.77
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.
1vrq SARCOSINE OXIDASE
ALPHA SUBUNIT


(Corynebacterium
sp. U-96)
PF01571
(GCV_T)
PF08669
(GCV_T_C)
PF12831
(FAD_oxidored)
PF13510
(Fer2_4)
4 MET A 815
ALA A 729
THR A 727
LEU A 631
None
None
None
FON  A1003 (-3.8A)
1.03A 2wx2B-1vrqA:
undetectable
2wx2B-1vrqA:
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.
1wc8 TRAFFICKING PROTEIN
PARTICLE COMPLEX
SUBUNIT3


(Mus musculus)
PF04051
(TRAPP)
4 MET A 165
ALA A  75
ALA A  79
LEU A 107
None
1.01A 2wx2B-1wc8A:
undetectable
2wx2B-1wc8A:
15.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1z9d URIDYLATE KINASE

(Streptococcus
pyogenes)
PF00696
(AA_kinase)
4 MET A 219
ALA A  34
ALA A  36
LEU A  51
None
0.88A 2wx2B-1z9dA:
undetectable
2wx2B-1z9dA:
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.
2cfo GLUTAMYL-TRNA
SYNTHETASE


(Synechococcus
elongatus)
PF00749
(tRNA-synt_1c)
4 ALA A 268
ALA A 272
THR A 276
LEU A  28
None
0.97A 2wx2B-2cfoA:
undetectable
2wx2B-2cfoA:
23.42
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.
2f5x BUGD

(Bordetella
pertussis)
PF03401
(TctC)
4 MET A 229
ALA A  23
ALA A  27
LEU A  34
None
0.82A 2wx2B-2f5xA:
undetectable
2wx2B-2f5xA:
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.
2fe8 REPLICASE
POLYPROTEIN 1AB


(Severe acute
respiratory
syndrome-related
coronavirus)
PF08715
(Viral_protease)
4 TYR A  72
TYR A  73
ALA A 154
ALA A 150
None
0.81A 2wx2B-2fe8A:
undetectable
2wx2B-2fe8A:
21.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2m5t HUMAN RHINOVIRUS 2A
PROTEINASE


(Rhinovirus C)
PF00947
(Pico_P2A)
4 ALA A  30
ALA A  33
THR A 120
LEU A  93
None
1.00A 2wx2B-2m5tA:
undetectable
2wx2B-2m5tA:
13.03
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.
2oqa LUFFACULIN 1

(Luffa
acutangula)
PF00161
(RIP)
4 TYR A  81
TYR A  74
ALA A 149
ALA A 145
None
0.91A 2wx2B-2oqaA:
undetectable
2wx2B-2oqaA:
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.
2pth PEPTIDYL-TRNA
HYDROLASE


(Escherichia
coli)
PF01195
(Pept_tRNA_hydro)
4 ALA A 164
ALA A 168
THR A 172
LEU A  89
None
0.95A 2wx2B-2pthA:
undetectable
2wx2B-2pthA:
16.77
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.
2q9g CYTOCHROME P450 46A1

(Homo sapiens)
PF00067
(p450)
4 TYR A 109
PHE A 121
ALA A 302
THR A 306
None
None
HEM  A 505 (-3.7A)
HEM  A 505 (-3.7A)
0.83A 2wx2B-2q9gA:
34.2
2wx2B-2q9gA:
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.
2w1p
AQUAPORIN PIP2-7 7


(Komagataella
pastoris)
PF00230
(MIP)
4 PHE A  56
ALA A 144
ALA A 148
THR A 152
None
0.74A 2wx2B-2w1pA:
undetectable
2wx2B-2w1pA:
18.09
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.
2whn PILUS ASSEMBLY
PROTEIN PILC


(Thermus
thermophilus)
PF00482
(T2SSF)
4 TYR A 131
ALA A  68
THR A  95
LEU A 104
None
0.96A 2wx2B-2whnA:
undetectable
2wx2B-2whnA:
15.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2wz9 GLUTAREDOXIN-3

(Homo sapiens)
PF00085
(Thioredoxin)
4 ALA A 103
ALA A 105
THR A 109
LEU A  56
None
1.04A 2wx2B-2wz9A:
undetectable
2wx2B-2wz9A:
16.28
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.
2ymv ACG NITROREDUCTASE

(Mycolicibacterium
smegmatis)
no annotation 4 ALA A  19
ALA A  15
THR A  11
LEU A   7
None
0.98A 2wx2B-2ymvA:
undetectable
2wx2B-2ymvA:
22.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2zay RESPONSE REGULATOR
RECEIVER PROTEIN


(Desulfuromonas
acetoxidans)
PF00072
(Response_reg)
4 MET A 103
PHE A 105
ALA A  87
ALA A  60
None
0.96A 2wx2B-2zayA:
undetectable
2wx2B-2zayA:
14.80
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.
3amj ZINC PEPTIDASE
INACTIVE SUBUNIT


(Sphingomonas
sp. A1)
PF00675
(Peptidase_M16)
PF05193
(Peptidase_M16_C)
4 TYR B  36
ALA B 223
ALA B 227
THR B 231
None
0.82A 2wx2B-3amjB:
undetectable
2wx2B-3amjB:
23.62
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.
3aux DNA DOUBLE-STRAND
BREAK REPAIR RAD50
ATPASE


(Methanocaldococcus
jannaschii)
PF13476
(AAA_23)
4 MET A 973
ALA A  29
THR A 949
LEU A 960
None
None
MG  A1050 (-3.0A)
None
0.97A 2wx2B-3auxA:
undetectable
2wx2B-3auxA:
22.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3bwh CUCURMOSIN

(Cucurbita
moschata)
PF00161
(RIP)
4 TYR A  81
TYR A  74
ALA A 148
ALA A 144
None
0.99A 2wx2B-3bwhA:
undetectable
2wx2B-3bwhA:
18.72
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.
3e7g NITRIC OXIDE
SYNTHASE, INDUCIBLE


(Homo sapiens)
PF02898
(NO_synthase)
4 TYR A 233
ALA A 214
THR A 190
LEU A 209
None
None
None
HEM  A 901 ( 4.9A)
0.94A 2wx2B-3e7gA:
undetectable
2wx2B-3e7gA:
21.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3fbl PUTATIVE
UNCHARACTERIZED
PROTEIN


(Acidianus
filamentous
virus 1)
no annotation 4 PHE A  78
ALA A 121
ALA A 125
THR A 129
None
1.04A 2wx2B-3fblA:
undetectable
2wx2B-3fblA:
10.93
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.
3god CAS1

(Pseudomonas
aeruginosa)
PF01867
(Cas_Cas1)
4 ALA A 233
ALA A 237
THR A 241
LEU A 313
None
0.79A 2wx2B-3godA:
undetectable
2wx2B-3godA:
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.
3hsi PHOSPHATIDYLSERINE
SYNTHASE


(Haemophilus
influenzae)
PF13091
(PLDc_2)
4 TYR A 277
TYR A 328
ALA A 323
ALA A 321
None
1.04A 2wx2B-3hsiA:
undetectable
2wx2B-3hsiA:
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.
3jd5 28S RIBOSOMAL
PROTEIN S2,
MITOCHONDRIAL
28S RIBOSOMAL
PROTEIN S9,
MITOCHONDRIAL


(Bos taurus)
PF00318
(Ribosomal_S2)
PF00380
(Ribosomal_S9)
4 TYR I 152
PHE B 160
ALA B 197
ALA B 201
None
0.61A 2wx2B-3jd5I:
undetectable
2wx2B-3jd5I:
23.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3krv HYDROLASE

(Geobacillus
stearothermophilus)
PF04199
(Cyclase)
4 MET A  42
ALA A 194
ALA A 196
THR A   7
None
0.98A 2wx2B-3krvA:
undetectable
2wx2B-3krvA:
20.45
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ksw STEROL 14-ALPHA
DEMETHYLASE


(Trypanosoma
cruzi)
PF00067
(p450)
5 TYR A 103
MET A 106
ALA A 287
ALA A 291
THR A 295
None
VNF  A 490 ( 3.8A)
VNF  A 490 ( 3.9A)
VNF  A 490 ( 4.0A)
VNF  A 490 ( 4.0A)
0.72A 2wx2B-3kswA:
41.6
2wx2B-3kswA:
97.24
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ksw STEROL 14-ALPHA
DEMETHYLASE


(Trypanosoma
cruzi)
PF00067
(p450)
5 TYR A 103
MET A 106
PHE A 110
ALA A 287
ALA A 291
None
VNF  A 490 ( 3.8A)
None
VNF  A 490 ( 3.9A)
VNF  A 490 ( 4.0A)
0.79A 2wx2B-3kswA:
41.6
2wx2B-3kswA:
97.24
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3l4d STEROL 14-ALPHA
DEMETHYLASE


(Leishmania
infantum)
PF00067
(p450)
6 MET A 105
PHE A 109
ALA A 286
ALA A 290
THR A 294
LEU A 355
TPF  A 490 ( 4.0A)
TPF  A 490 (-4.5A)
TPF  A 490 (-3.4A)
TPF  A 490 ( 3.4A)
TPF  A 490 ( 3.5A)
TPF  A 490 (-4.4A)
0.97A 2wx2B-3l4dA:
50.9
2wx2B-3l4dA:
74.46
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3l4d STEROL 14-ALPHA
DEMETHYLASE


(Leishmania
infantum)
PF00067
(p450)
5 MET A 105
PHE A 109
TYR A 102
ALA A 290
THR A 294
TPF  A 490 ( 4.0A)
TPF  A 490 (-4.5A)
HEM  A 481 (-4.7A)
TPF  A 490 ( 3.4A)
TPF  A 490 ( 3.5A)
1.36A 2wx2B-3l4dA:
50.9
2wx2B-3l4dA:
74.46
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3l4d STEROL 14-ALPHA
DEMETHYLASE


(Leishmania
infantum)
PF00067
(p450)
7 TYR A 102
MET A 105
TYR A 115
ALA A 286
ALA A 290
THR A 294
LEU A 355
HEM  A 481 (-4.7A)
TPF  A 490 ( 4.0A)
HEM  A 481 ( 4.9A)
TPF  A 490 (-3.4A)
TPF  A 490 ( 3.4A)
TPF  A 490 ( 3.5A)
TPF  A 490 (-4.4A)
0.58A 2wx2B-3l4dA:
50.9
2wx2B-3l4dA:
74.46
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.
3l76 ASPARTOKINASE

(Synechocystis
sp. PCC 6803)
PF00696
(AA_kinase)
PF01842
(ACT)
PF13840
(ACT_7)
4 ALA A 165
ALA A 161
THR A 157
LEU A 150
None
1.02A 2wx2B-3l76A:
undetectable
2wx2B-3l76A:
21.45
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.
3mmp RNA-DIRECTED RNA
POLYMERASE BETA
CHAIN


(Escherichia
virus Qbeta)
no annotation 4 TYR G 411
ALA G  30
ALA G  34
LEU G  71
None
0.75A 2wx2B-3mmpG:
undetectable
2wx2B-3mmpG:
21.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3oms PHNB PROTEIN

(Bacillus cereus)
PF06983
(3-dmu-9_3-mt)
4 PHE A  14
ALA A  18
THR A  26
LEU A  58
None
0.72A 2wx2B-3omsA:
undetectable
2wx2B-3omsA:
15.33
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.
3p5m ENOYL-COA
HYDRATASE/ISOMERASE


(Mycobacterium
avium)
PF00378
(ECH_1)
4 ALA A 107
ALA A 109
THR A  85
LEU A 210
None
0.96A 2wx2B-3p5mA:
undetectable
2wx2B-3p5mA:
19.29
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.
3p5m ENOYL-COA
HYDRATASE/ISOMERASE


(Mycobacterium
avium)
PF00378
(ECH_1)
4 ALA A 107
ALA A 109
THR A  85
LEU A 213
None
1.02A 2wx2B-3p5mA:
undetectable
2wx2B-3p5mA:
19.29
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.
3q2i DEHYDROGENASE

(Chromobacterium
violaceum)
PF01408
(GFO_IDH_MocA)
PF02894
(GFO_IDH_MocA_C)
4 ALA A  49
ALA A  53
THR A  57
LEU A  39
NAI  A 500 ( 3.9A)
None
None
None
1.02A 2wx2B-3q2iA:
undetectable
2wx2B-3q2iA:
20.45
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.
3q2k OXIDOREDUCTASE

(Bordetella
pertussis)
PF01408
(GFO_IDH_MocA)
PF02894
(GFO_IDH_MocA_C)
4 ALA A  48
ALA A  52
THR A  56
LEU A  38
NAI  A 500 ( 3.9A)
None
None
None
1.02A 2wx2B-3q2kA:
undetectable
2wx2B-3q2kA:
22.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3qi6 CYSTATHIONINE
GAMMA-SYNTHASE METB
(CGS)


(Mycobacterium
ulcerans)
PF01053
(Cys_Met_Meta_PP)
4 PHE A  83
ALA A  89
ALA A  93
LEU A 228
None
0.87A 2wx2B-3qi6A:
undetectable
2wx2B-3qi6A:
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.
3qki GLUCOSE-6-PHOSPHATE
ISOMERASE


(Plasmodium
falciparum)
PF00342
(PGI)
4 TYR A 172
PHE A 310
TYR A 175
ALA A 309
None
0.95A 2wx2B-3qkiA:
undetectable
2wx2B-3qkiA:
21.84
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.
3uon HUMAN M2 MUSCARINIC
ACETYLCHOLINE,
RECEPTOR T4 LYSOZYME
FUSION PROTEIN


(Escherichia
virus T4;
Homo sapiens)
PF00001
(7tm_1)
PF00959
(Phage_lysozyme)
4 TYR A 440
ALA A 391
ALA A 395
THR A 399
None
0.95A 2wx2B-3uonA:
undetectable
2wx2B-3uonA:
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.
3vvd AMINO ACID ABC
TRANSPORTER, BINDING
PROTEIN


(Thermus
thermophilus)
PF00497
(SBP_bac_3)
4 MET A 195
PHE A  74
ALA A  46
LEU A 215
None
1.03A 2wx2B-3vvdA:
undetectable
2wx2B-3vvdA:
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.
3wiw GLYCOSYL HYDROLASE
FAMILY 88


(Pedobacter
heparinus)
PF07470
(Glyco_hydro_88)
5 MET A 284
PHE A 294
ALA A 245
ALA A 249
LEU A 316
None
1.19A 2wx2B-3wiwA:
undetectable
2wx2B-3wiwA:
22.49
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.
3wwx S12 FAMILY PEPTIDASE

(Streptomyces
sp. 82F2)
PF00144
(Beta-lactamase)
4 TYR A  82
ALA A 345
THR A  43
LEU A  47
None
1.01A 2wx2B-3wwxA:
undetectable
2wx2B-3wwxA:
20.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4c1t SUGAR TRANSPORTER
SOLUTE-BINDING
PROTEIN


(Bifidobacterium
animalis)
PF01547
(SBP_bac_1)
4 MET A 150
ALA A 270
ALA A 186
LEU A 238
None
0.84A 2wx2B-4c1tA:
undetectable
2wx2B-4c1tA:
18.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4co8 ETS TRANSLOCATION
VARIANT 4


(Homo sapiens)
PF00178
(Ets)
4 TYR A 418
MET A 408
PHE A 420
LEU A 395
None
0.88A 2wx2B-4co8A:
undetectable
2wx2B-4co8A:
18.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4emo SHARPIN

(Homo sapiens)
PF16764
(Sharpin_PH)
4 MET A 101
PHE A 103
ALA A 109
ALA A 113
None
0.74A 2wx2B-4emoA:
undetectable
2wx2B-4emoA:
14.10
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.
4emo SHARPIN

(Homo sapiens)
PF16764
(Sharpin_PH)
4 MET A 101
PHE A 103
ALA A 109
LEU A  58
None
0.99A 2wx2B-4emoA:
undetectable
2wx2B-4emoA:
14.10
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.
4evz HISF-LUCA

(synthetic
construct)
PF00977
(His_biosynth)
4 PHE A 228
ALA A 224
ALA A 222
LEU A 242
None
PI  A 301 (-3.8A)
None
None
1.03A 2wx2B-4evzA:
undetectable
2wx2B-4evzA:
20.75
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4g3j STEROL
14-ALPHA-DEMETHYLASE


(Trypanosoma
brucei)
PF00067
(p450)
6 MET A 106
PHE A 110
ALA A 287
ALA A 291
THR A 295
LEU A 356
VNT  A 502 ( 3.9A)
VNT  A 502 (-4.4A)
VNT  A 502 ( 3.9A)
HEM  A 501 ( 3.5A)
VNT  A 502 ( 3.2A)
VNT  A 502 ( 4.5A)
0.84A 2wx2B-4g3jA:
52.6
2wx2B-4g3jA:
82.47
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4g3j STEROL
14-ALPHA-DEMETHYLASE


(Trypanosoma
brucei)
PF00067
(p450)
6 PHE A 110
TYR A 116
ALA A 287
ALA A 291
THR A 295
LEU A 356
VNT  A 502 (-4.4A)
HEM  A 501 ( 4.5A)
VNT  A 502 ( 3.9A)
HEM  A 501 ( 3.5A)
VNT  A 502 ( 3.2A)
VNT  A 502 ( 4.5A)
0.66A 2wx2B-4g3jA:
52.6
2wx2B-4g3jA:
82.47
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4g3j STEROL
14-ALPHA-DEMETHYLASE


(Trypanosoma
brucei)
PF00067
(p450)
4 TYR A 103
ALA A 287
ALA A 291
THR A 295
VNT  A 502 ( 4.8A)
VNT  A 502 ( 3.9A)
HEM  A 501 ( 3.5A)
VNT  A 502 ( 3.2A)
0.66A 2wx2B-4g3jA:
52.6
2wx2B-4g3jA:
82.47
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4g3j STEROL
14-ALPHA-DEMETHYLASE


(Trypanosoma
brucei)
PF00067
(p450)
4 TYR A 103
ALA A 288
THR A 295
LEU A 356
VNT  A 502 ( 4.8A)
HEM  A 501 (-4.4A)
VNT  A 502 ( 3.2A)
VNT  A 502 ( 4.5A)
1.04A 2wx2B-4g3jA:
52.6
2wx2B-4g3jA:
82.47
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4g3j STEROL
14-ALPHA-DEMETHYLASE


(Trypanosoma
brucei)
PF00067
(p450)
4 TYR A 103
TYR A 116
THR A 295
LEU A 356
VNT  A 502 ( 4.8A)
HEM  A 501 ( 4.5A)
VNT  A 502 ( 3.2A)
VNT  A 502 ( 4.5A)
1.03A 2wx2B-4g3jA:
52.6
2wx2B-4g3jA:
82.47
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.
4hz4 GLUTATHIONE-S-TRANSF
ERASE


(Actinobacillus
pleuropneumoniae)
PF00043
(GST_C)
PF02798
(GST_N)
4 ALA A 193
ALA A 197
THR A 201
LEU A  30
None
0.70A 2wx2B-4hz4A:
undetectable
2wx2B-4hz4A:
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.
4jso OLIGOPEPTIDE ABC
TRANSPORTER,
PERIPLASMIC
OLIGOPEPTIDE-BINDING
PROTEIN


(Thermotoga
maritima)
PF00496
(SBP_bac_5)
4 TYR A 298
ALA A 504
ALA A 305
LEU A 313
None
1.01A 2wx2B-4jsoA:
undetectable
2wx2B-4jsoA:
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.
4k05 CONSERVED
HYPOTHETICAL
EXPORTED PROTEIN


(Bacteroides
fragilis)
PF07075
(DUF1343)
4 TYR A 119
TYR A  90
ALA A 160
ALA A 163
None
0.88A 2wx2B-4k05A:
undetectable
2wx2B-4k05A:
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.
4l0c DEFORMYLASE

(Pseudomonas
putida)
PF12697
(Abhydrolase_6)
4 MET A   1
PHE A  18
ALA A  42
LEU A 166
None
1.02A 2wx2B-4l0cA:
undetectable
2wx2B-4l0cA:
19.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4mt1 DRUG EFFLUX PROTEIN

(Neisseria
gonorrhoeae)
PF00873
(ACR_tran)
4 PHE A 626
ALA A 639
ALA A 643
THR A 647
None
0.83A 2wx2B-4mt1A:
undetectable
2wx2B-4mt1A:
18.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4nq1 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE


(Legionella
pneumophila)
PF00701
(DHDPS)
4 ALA A  74
ALA A  41
THR A  11
LEU A  23
None
0.91A 2wx2B-4nq1A:
undetectable
2wx2B-4nq1A:
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.
4rhz CRY23AA1
CRY37AA1


(Bacillus
thuringiensis)
PF03318
(ETX_MTX2)
no annotation
4 TYR B 121
ALA B  29
THR A 247
LEU A 249
None
1.04A 2wx2B-4rhzB:
undetectable
2wx2B-4rhzB:
14.56
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.
4u14 MUSCARINIC
ACETYLCHOLINE
RECEPTOR
M3,ENDOLYSIN,MUSCARI
NIC ACETYLCHOLINE
RECEPTOR M3


(Escherichia
virus T4;
Rattus
norvegicus)
PF00001
(7tm_1)
PF00959
(Phage_lysozyme)
4 TYR A 543
ALA A 494
ALA A 498
THR A 502
None
0.96A 2wx2B-4u14A:
undetectable
2wx2B-4u14A:
21.89
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4uhi STEROL 14-ALPHA
DEMETHYLASE


(Homo sapiens)
PF00067
(p450)
5 TYR A 131
PHE A 139
TYR A 145
ALA A 311
THR A 315
VFV  A 580 (-4.1A)
VFV  A 580 (-4.2A)
HEM  A 540 (-4.5A)
HEM  A 540 ( 3.4A)
HEM  A 540 (-3.6A)
0.48A 2wx2B-4uhiA:
34.3
2wx2B-4uhiA:
35.79
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4uym 14-ALPHA STEROL
DEMETHYLASE


(Aspergillus
fumigatus)
PF00067
(p450)
5 TYR A 122
PHE A 130
TYR A 136
ALA A 303
ALA A 307
VOR  A 590 (-3.8A)
VOR  A 590 (-4.6A)
HEM  A 580 (-4.6A)
VOR  A 590 ( 4.4A)
VOR  A 590 ( 4.0A)
0.58A 2wx2B-4uymA:
38.1
2wx2B-4uymA:
31.30
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.
4wp0 KYNURENINE--OXOGLUTA
RATE TRANSAMINASE 1


(Homo sapiens)
PF00155
(Aminotran_1_2)
4 MET A 131
TYR A 128
ALA A 107
ALA A 103
None
0.99A 2wx2B-4wp0A:
undetectable
2wx2B-4wp0A:
22.73
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.
4zi6 CYTOSOL
AMINOPEPTIDASE


(Helicobacter
pylori)
PF00883
(Peptidase_M17)
PF02789
(Peptidase_M17_N)
4 ALA A 163
ALA A 167
THR A 171
LEU A 118
None
0.95A 2wx2B-4zi6A:
undetectable
2wx2B-4zi6A:
21.75
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.
5a08 PROBABLE
MANNOSYLTRANSFERASE
KTR4


(Saccharomyces
cerevisiae)
PF01793
(Glyco_transf_15)
4 TYR A 342
ALA A 393
ALA A 391
LEU A 371
None
0.91A 2wx2B-5a08A:
undetectable
2wx2B-5a08A:
18.77
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.
5axh DEXTRANASE

(Thermoanaerobacter
pseudethanolicus)
PF13199
(Glyco_hydro_66)
4 TYR A 235
TYR A 184
THR A 276
LEU A 279
GLC  A 703 ( 4.7A)
GLC  A 703 ( 4.4A)
None
None
1.01A 2wx2B-5axhA:
undetectable
2wx2B-5axhA:
21.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5c0u ALKYLMERCURY LYASE

(Escherichia
coli)
PF03243
(MerB)
PF12324
(HTH_15)
4 PHE A 165
ALA A 171
ALA A 175
LEU A 181
None
0.76A 2wx2B-5c0uA:
undetectable
2wx2B-5c0uA:
19.28
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.
5exe OXALATE
OXIDOREDUCTASE
SUBUNIT DELTA


(Moorella
thermoacetica)
PF00037
(Fer4)
PF01558
(POR)
4 TYR B 200
MET B 196
ALA B  34
ALA B  38
None
0.87A 2wx2B-5exeB:
undetectable
2wx2B-5exeB:
18.68
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.
5f15 4-AMINO-4-DEOXY-L-AR
ABINOSE (L-ARA4N)
TRANSFERASE


(Cupriavidus
metallidurans)
PF13231
(PMT_2)
4 TYR A 218
ALA A 328
ALA A 352
LEU A 173
None
MPG  A 614 ( 3.9A)
None
None
0.93A 2wx2B-5f15A:
undetectable
2wx2B-5f15A:
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.
5fcl CRISPR-ASSOCIATED
ENDONUCLEASE CAS1


(Pectobacterium
atrosepticum)
PF01867
(Cas_Cas1)
4 ALA A 234
ALA A 238
THR A 242
LEU A 314
None
0.89A 2wx2B-5fclA:
undetectable
2wx2B-5fclA:
21.62
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5fsa CYP51 VARIANT1

(Candida
albicans)
PF00067
(p450)
4 TYR A 118
PHE A 126
TYR A 132
THR A 311
X2N  A 590 ( 4.0A)
X2N  A 590 (-4.8A)
HEM  A 580 (-4.1A)
HEM  A 580 (-3.6A)
0.50A 2wx2B-5fsaA:
36.3
2wx2B-5fsaA:
32.50
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.
5fsh CSM6

(Thermus
thermophilus)
PF09670
(Cas_Cas02710)
4 ALA A  63
ALA A  65
THR A  95
LEU A  99
None
1.02A 2wx2B-5fshA:
undetectable
2wx2B-5fshA:
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.
5gmx CARBOXYLESTERASE

(uncultured
bacterium)
PF00144
(Beta-lactamase)
4 TYR A  92
ALA A 169
ALA A 173
THR A 177
None
0.95A 2wx2B-5gmxA:
undetectable
2wx2B-5gmxA:
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.
5hs1 LANOSTEROL 14-ALPHA
DEMETHYLASE


(Saccharomyces
cerevisiae)
PF00067
(p450)
5 TYR A 126
PHE A 134
TYR A 140
THR A 318
LEU A 380
VOR  A 602 ( 3.8A)
VOR  A 602 (-4.7A)
HEM  A 601 (-4.3A)
HEM  A 601 (-3.4A)
VOR  A 602 (-4.0A)
0.40A 2wx2B-5hs1A:
36.5
2wx2B-5hs1A:
29.17
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.
5ilu ETS TRANSLOCATION
VARIANT 4


(Homo sapiens)
PF00178
(Ets)
4 TYR A 418
MET A 408
PHE A 420
LEU A 395
None
0.88A 2wx2B-5iluA:
undetectable
2wx2B-5iluA:
11.48
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.
5jlc LANOSTEROL 14-ALPHA
DEMETHYLASE


([Candida]
glabrata)
PF00067
(p450)
5 TYR A 127
PHE A 135
TYR A 141
THR A 319
LEU A 381
1YN  A 602 ( 3.8A)
1YN  A 602 ( 4.6A)
HEM  A 601 (-4.2A)
HEM  A 601 ( 3.5A)
1YN  A 602 ( 4.7A)
0.51A 2wx2B-5jlcA:
35.9
2wx2B-5jlcA:
29.55
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.
5k3h ACYL-COENZYME A
OXIDASE


(Caenorhabditis
elegans)
PF01756
(ACOX)
PF02770
(Acyl-CoA_dh_M)
PF14749
(Acyl-CoA_ox_N)
4 ALA A 353
ALA A 357
THR A 361
LEU A 386
None
0.78A 2wx2B-5k3hA:
undetectable
2wx2B-5k3hA:
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.
5kei 2,3-DIHYDROXYBENZOAT
E-AMP LIGASE


(Mycolicibacterium
smegmatis)
PF00501
(AMP-binding)
PF13193
(AMP-binding_C)
4 TYR A 249
ALA A 290
ALA A 287
LEU A 301
None
0.85A 2wx2B-5keiA:
undetectable
2wx2B-5keiA:
23.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5nii THIOREDOXIN
REDUCTASE


(Desulfovibrio
vulgaris)
no annotation 4 ALA A  14
ALA A  18
THR A  22
LEU A   6
FAD  A 401 (-3.3A)
None
None
None
1.01A 2wx2B-5niiA:
undetectable
2wx2B-5niiA:
10.11
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.
5umu FACT COMPLEX SUBUNIT
SPT16


(Homo sapiens)
no annotation 4 TYR A 864
MET A 906
THR A 894
LEU A 842
None
None
FMT  A1006 (-3.7A)
FMT  A1003 ( 3.5A)
0.78A 2wx2B-5umuA:
undetectable
2wx2B-5umuA:
10.36
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.
5w3f TUBULIN ALPHA-1
CHAIN


(Saccharomyces
cerevisiae)
PF00091
(Tubulin)
PF03953
(Tubulin_C)
4 TYR A 409
MET A 414
ALA A 422
THR A 192
None
0.94A 2wx2B-5w3fA:
undetectable
2wx2B-5w3fA:
21.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5xb7 BETA-GALACTOSIDASE

(Bifidobacterium
animalis)
no annotation 4 ALA A 404
ALA A 452
THR A 477
LEU A 481
None
1.03A 2wx2B-5xb7A:
undetectable
2wx2B-5xb7A:
22.54
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.
5xmj FUMARATE REDUCTASE
FLAVOPROTEIN SUBUNIT


(Desulfovibrio
gigas)
no annotation 4 MET A  33
ALA A 215
ALA A  16
LEU A 164
None
FAD  A 701 (-4.5A)
FAD  A 701 (-3.9A)
None
1.03A 2wx2B-5xmjA:
undetectable
2wx2B-5xmjA:
10.47
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6ay4 CYP51, STEROL
14ALPHA-DEMETHYLASE


(Naegleria
fowleri)
no annotation 7 TYR A 107
MET A 110
PHE A 114
ALA A 289
ALA A 293
THR A 297
LEU A 358
TPF  A 506 (-4.2A)
TPF  A 506 (-4.6A)
TPF  A 506 (-4.4A)
TPF  A 506 (-3.5A)
TPF  A 506 ( 3.2A)
HEM  A 501 (-3.4A)
TPF  A 506 ( 4.4A)
0.69A 2wx2B-6ay4A:
42.7
2wx2B-6ay4A:
36.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6ay4 CYP51, STEROL
14ALPHA-DEMETHYLASE


(Naegleria
fowleri)
no annotation 7 TYR A 107
MET A 110
TYR A 120
ALA A 289
ALA A 293
THR A 297
LEU A 358
TPF  A 506 (-4.2A)
TPF  A 506 (-4.6A)
None
TPF  A 506 (-3.5A)
TPF  A 506 ( 3.2A)
HEM  A 501 (-3.4A)
TPF  A 506 ( 4.4A)
0.71A 2wx2B-6ay4A:
42.7
2wx2B-6ay4A:
36.59
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.
6chs PUTATIVE CELL
DIVISION CONTROL
PROTEIN


(Chaetomium
thermophilum)
no annotation 4 ALA H 271
ALA H 275
THR H 278
LEU H 240
None
0.91A 2wx2B-6chsH:
undetectable
2wx2B-6chsH:
11.35
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.
6fn1 HUMAN-MOUSE CHIMERIC
ABCB1 (ABCBHM)


(Homo sapiens)
no annotation 4 TYR A 789
ALA A 249
ALA A 253
LEU A 796
None
1.03A 2wx2B-6fn1A:
undetectable
2wx2B-6fn1A:
10.99