SIMILAR PATTERNS OF AMINO ACIDS FOR 4R21_B_STRB601

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.
1cyd CARBONYL REDUCTASE

(Mus musculus)
PF13561
(adh_short_C2)
5 ALA A  36
ILE A 219
VAL A 216
GLY A  20
ILE A  54
None
1.00A 4r21B-1cydA:
0.0
4r21B-1cydA:
19.88
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.
1dm3 BIOSYNTHETIC
THIOLASE ACETYLATED
AT CYS89


(Zoogloea
ramigera)
PF00108
(Thiolase_N)
PF02803
(Thiolase_C)
5 ALA A 256
VAL A 385
GLY A  92
ALA A 355
ILE A   7
None
1.10A 4r21B-1dm3A:
undetectable
4r21B-1dm3A:
20.00
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.
1hvc HIV-1 PROTEASE

(Human
immunodeficiency
virus 1)
PF00077
(RVP)
5 ILE A  84
VAL A  82
GLY A  27
ALA A  28
ILE A  47
A79  A 800 (-3.6A)
A79  A 800 (-4.5A)
A79  A 800 (-3.0A)
A79  A 800 (-3.2A)
A79  A 800 ( 3.4A)
1.07A 4r21B-1hvcA:
undetectable
4r21B-1hvcA:
17.72
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.
1hvc HIV-1 PROTEASE

(Human
immunodeficiency
virus 1)
PF00077
(RVP)
5 ILE A  84
VAL A  82
GLY A  27
ALA A  28
ILE A  47
A79  A 800 (-3.8A)
A79  A 800 (-4.5A)
A79  A 800 (-3.0A)
A79  A 800 (-3.1A)
A79  A 800 ( 3.2A)
1.05A 4r21B-1hvcA:
undetectable
4r21B-1hvcA:
17.72
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.
1l7p PHOSPHOSERINE
PHOSPHATASE


(Methanocaldococcus
jannaschii)
PF12710
(HAD)
5 ALA A 105
GLY A 100
ALA A 120
ILE A 104
VAL A 134
None
SEP  A 770 (-3.7A)
None
None
None
1.03A 4r21B-1l7pA:
undetectable
4r21B-1l7pA:
17.70
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.
1obh LEUCYL-TRNA
SYNTHETASE


(Thermus
thermophilus)
PF00133
(tRNA-synt_1)
PF08264
(Anticodon_1)
PF13603
(tRNA-synt_1_2)
PF14795
(Leucyl-specific)
5 ALA A 311
VAL A 305
GLY A 308
ALA A 309
ILE A 243
None
1.06A 4r21B-1obhA:
2.6
4r21B-1obhA:
19.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1pq5 TRYPSIN

(Fusarium
oxysporum)
PF00089
(Trypsin)
6 ILE A  30
VAL A  31
GLY A 197
ALA A 209
ILE A 235
VAL A  51
None
1.31A 4r21B-1pq5A:
undetectable
4r21B-1pq5A:
17.70
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.
1sqj OLIGOXYLOGLUCAN
REDUCING-END-SPECIFI
C CELLOBIOHYDROLASE


(Geotrichum sp.
M128)
PF15899
(BNR_6)
5 ALA A 383
ILE A  11
GLY A  14
ALA A 416
VAL A 367
None
1.08A 4r21B-1sqjA:
undetectable
4r21B-1sqjA:
18.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1tlt PUTATIVE
OXIDOREDUCTASE
(VIRULENCE FACTOR
MVIM HOMOLOG)


(Escherichia
coli)
PF01408
(GFO_IDH_MocA)
5 ALA A  36
ILE A  16
GLY A  14
SER A  50
ILE A  53
None
1.10A 4r21B-1tltA:
0.0
4r21B-1tltA:
23.94
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.
1ud3 AMYLASE

(Bacillus sp.
KSM-K38)
PF00128
(Alpha-amylase)
PF09154
(DUF1939)
5 ALA A 137
ILE A 174
VAL A 120
GLY A 162
THR A 180
None
0.96A 4r21B-1ud3A:
undetectable
4r21B-1ud3A:
19.44
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.
1vme FLAVOPROTEIN

(Thermotoga
maritima)
PF00258
(Flavodoxin_1)
5 ALA A 274
ILE A 259
GLY A 314
ILE A 390
VAL A 343
None
0.99A 4r21B-1vmeA:
undetectable
4r21B-1vmeA:
20.00
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.
1xw8 UPF0271 PROTEIN YBGL

(Escherichia
coli)
PF03746
(LamB_YcsF)
5 ALA A  93
VAL A 127
GLY A  87
ILE A  54
VAL A 103
None
1.07A 4r21B-1xw8A:
undetectable
4r21B-1xw8A:
20.78
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.
1ysj PROTEIN YXEP

(Bacillus
subtilis)
PF01546
(Peptidase_M20)
PF07687
(M20_dimer)
5 VAL A 363
GLY A 312
ALA A 309
THR A 315
ILE A 374
None
0.99A 4r21B-1ysjA:
undetectable
4r21B-1ysjA:
20.12
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.
2eis HYPOTHETICAL PROTEIN
TTHB207


(Thermus
thermophilus)
PF03061
(4HBT)
5 ILE A  65
VAL A  66
GLY A  63
THR A  15
VAL A  60
None
1.06A 4r21B-2eisA:
undetectable
4r21B-2eisA:
13.27
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.
2gks BIFUNCTIONAL SAT/APS
KINASE


(Aquifex
aeolicus)
PF01583
(APS_kinase)
PF01747
(ATP-sulfurylase)
PF14306
(PUA_2)
5 ILE A 430
GLY A 434
ALA A 437
ILE A 448
VAL A 411
None
1.10A 4r21B-2gksA:
undetectable
4r21B-2gksA:
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.
2gn1 THREONINE
DEHYDRATASE
CATABOLIC


(Salmonella
enterica)
PF00291
(PALP)
5 ILE A 250
VAL A 251
GLY A 191
ILE A 203
VAL A 255
None
1.07A 4r21B-2gn1A:
undetectable
4r21B-2gn1A:
22.02
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.
2h6e D-ARABINOSE
1-DEHYDROGENASE


(Sulfolobus
solfataricus)
PF00107
(ADH_zinc_N)
PF08240
(ADH_N)
5 ALA A 158
ILE A 312
GLY A 152
ILE A 243
VAL A 184
None
1.01A 4r21B-2h6eA:
undetectable
4r21B-2h6eA:
22.62
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2hi4 CYTOCHROME P450 1A2

(Homo sapiens)
PF00067
(p450)
5 GLY A 316
ALA A 317
THR A 321
ILE A 386
VAL A 227
BHF  A 800 (-3.8A)
HEM  A 900 ( 3.5A)
HEM  A 900 ( 3.1A)
HEM  A 900 (-4.0A)
None
1.01A 4r21B-2hi4A:
40.9
4r21B-2hi4A:
33.60
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.
2jjd RECEPTOR-TYPE
TYROSINE-PROTEIN
PHOSPHATASE EPSILON


(Homo sapiens)
PF00102
(Y_phosphatase)
5 ALA A 498
GLY A 635
ALA A 634
ILE A 487
VAL A 662
None
1.04A 4r21B-2jjdA:
2.2
4r21B-2jjdA:
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.
2nq2 HYPOTHETICAL ABC
TRANSPORTER PERMEASE
PROTEIN HI1471


(Haemophilus
influenzae)
PF01032
(FecCD)
5 ILE A 260
GLY A  73
ALA A 291
ILE A  66
VAL A 297
None
1.09A 4r21B-2nq2A:
undetectable
4r21B-2nq2A:
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.
2nr4 CONSERVED
HYPOTHETICAL PROTEIN


(Methanosarcina
mazei)
PF04289
(DUF447)
5 VAL A 102
GLY A 143
ALA A 117
ILE A  32
VAL A 111
None
0.94A 4r21B-2nr4A:
undetectable
4r21B-2nr4A:
17.46
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.
2nx8 TRNA-SPECIFIC
ADENOSINE DEAMINASE


(Streptococcus
pyogenes)
PF14437
(MafB19-deam)
5 ILE A 111
VAL A 110
GLY A 113
ALA A 114
SER A 124
None
1.01A 4r21B-2nx8A:
undetectable
4r21B-2nx8A:
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.
2nzt HEXOKINASE-2

(Homo sapiens)
PF00349
(Hexokinase_1)
PF03727
(Hexokinase_2)
5 VAL A 659
GLY A 900
ALA A 902
THR A 905
VAL A 655
None
1.04A 4r21B-2nztA:
undetectable
4r21B-2nztA:
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.
2pk0 SERINE/THREONINE
PROTEIN PHOSPHATASE
STP1


(Streptococcus
agalactiae)
PF13672
(PP2C_2)
5 ILE A   3
THR A 234
SER A 119
ILE A 101
VAL A 189
None
1.09A 4r21B-2pk0A:
undetectable
4r21B-2pk0A:
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.
2wtb FATTY ACID
MULTIFUNCTIONAL
PROTEIN (ATMFP2)


(Arabidopsis
thaliana)
PF00378
(ECH_1)
PF00725
(3HCDH)
PF02737
(3HCDH_N)
5 ILE A 647
VAL A 490
GLY A 495
SER A 425
VAL A 463
None
1.03A 4r21B-2wtbA:
undetectable
4r21B-2wtbA:
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.
2wxu PHOSPHOLIPASE C

(Clostridium
perfringens)
PF00882
(Zn_dep_PLPC)
PF01477
(PLAT)
5 ALA A 193
ILE A  14
VAL A  15
GLY A 129
SER A 102
None
0.96A 4r21B-2wxuA:
1.9
4r21B-2wxuA:
19.67
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.
2zu0 PROTEIN SUFD

(Escherichia
coli)
PF01458
(UPF0051)
5 ALA A 169
ILE A  69
GLY A  67
ALA A  66
VAL A  94
None
0.89A 4r21B-2zu0A:
undetectable
4r21B-2zu0A:
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.
3d3w L-XYLULOSE REDUCTASE

(Homo sapiens)
PF13561
(adh_short_C2)
5 ALA B  36
ILE B 219
VAL B 216
GLY B  20
ILE B  54
None
0.97A 4r21B-3d3wB:
undetectable
4r21B-3d3wB:
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.
3d6n ASPARTATE
CARBAMOYLTRANSFERASE


(Aquifex
aeolicus)
PF00185
(OTCace)
PF02729
(OTCace_N)
5 VAL B 160
GLY B 120
ALA B 119
THR B  48
ILE B 285
None
None
None
FLC  B 292 (-4.1A)
None
0.97A 4r21B-3d6nB:
undetectable
4r21B-3d6nB:
20.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3f8r THIOREDOXIN
REDUCTASE (TRXB-3)


(Sulfolobus
solfataricus)
PF07992
(Pyr_redox_2)
5 ALA A  30
VAL A 123
GLY A 286
ALA A 285
ILE A  20
None
None
NAP  A4005 (-3.3A)
None
None
1.04A 4r21B-3f8rA:
undetectable
4r21B-3f8rA:
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.
3fpz THIAZOLE
BIOSYNTHETIC ENZYME


(Saccharomyces
cerevisiae)
PF01946
(Thi4)
5 GLY A 307
ALA A 308
SER A 277
ILE A 275
VAL A 314
None
1.05A 4r21B-3fpzA:
undetectable
4r21B-3fpzA:
22.00
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.
3g05 TRNA URIDINE
5-CARBOXYMETHYLAMINO
METHYL MODIFICATION
ENZYME MNMG


(Escherichia
coli)
PF01134
(GIDA)
PF13932
(GIDA_assoc)
5 ALA A  21
GLY A 369
ALA A 368
ILE A  11
VAL A 155
None
SO4  A 551 ( 3.7A)
None
None
SO4  A 551 ( 4.9A)
0.76A 4r21B-3g05A:
undetectable
4r21B-3g05A:
22.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3hfw PROTEIN
ADP-RIBOSYLARGININE
HYDROLASE


(Homo sapiens)
PF03747
(ADP_ribosyl_GH)
5 VAL A 183
GLY A 139
SER A  11
ILE A 309
VAL A 316
None
0.94A 4r21B-3hfwA:
undetectable
4r21B-3hfwA:
20.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3i8b XYLULOSE KINASE

(Bifidobacterium
adolescentis)
PF00370
(FGGY_N)
PF02782
(FGGY_C)
5 ALA A 327
GLY A 311
ALA A 312
SER A 419
ILE A 417
None
1.09A 4r21B-3i8bA:
undetectable
4r21B-3i8bA:
22.78
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.
3ius UNCHARACTERIZED
CONSERVED PROTEIN


(Ruegeria
pomeroyi)
no annotation 5 ILE A 185
VAL A 182
SER A  44
ILE A  28
VAL A  16
None
None
None
None
EDO  A 286 (-3.7A)
1.05A 4r21B-3iusA:
undetectable
4r21B-3iusA:
19.66
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.
3j09 COPPER-EXPORTING
P-TYPE ATPASE A


(Archaeoglobus
fulgidus)
PF00122
(E1-E2_ATPase)
PF00403
(HMA)
PF00702
(Hydrolase)
5 ALA A 169
ILE A 343
VAL A 339
GLY A 109
ALA A 108
None
0.96A 4r21B-3j09A:
undetectable
4r21B-3j09A:
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.
3mpw ETHANOLAMINE
UTILIZATION PROTEIN
EUTM


(Escherichia
coli)
no annotation 5 ALA G  26
ILE G   7
VAL G  72
GLY G  59
ALA G  58
None
1.02A 4r21B-3mpwG:
undetectable
4r21B-3mpwG:
13.17
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.
3omx CG14216

(Drosophila
melanogaster)
PF04722
(Ssu72)
5 VAL A 140
GLY A 152
ALA A 153
THR A 157
VAL A 110
None
0.99A 4r21B-3omxA:
undetectable
4r21B-3omxA:
15.11
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3pm0 CYTOCHROME P450 1B1

(Homo sapiens)
PF00067
(p450)
5 ALA A 133
GLY A 329
ALA A 330
THR A 334
ILE A 399
HEM  A 900 (-3.3A)
BHF  A 800 ( 4.0A)
HEM  A 900 ( 3.4A)
HEM  A 900 ( 3.2A)
HEM  A 900 (-4.0A)
0.50A 4r21B-3pm0A:
41.6
4r21B-3pm0A:
34.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3r0o CARNITINYL-COA
DEHYDRATASE


(Mycobacterium
avium)
PF00378
(ECH_1)
5 ALA A 108
ILE A 205
ALA A 198
ILE A  61
VAL A  21
None
1.10A 4r21B-3r0oA:
undetectable
4r21B-3r0oA:
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.
3sze SERINE PROTEASE ESPP

(Escherichia
coli)
PF02395
(Peptidase_S6)
5 VAL A 166
GLY A 171
ALA A 172
THR A 115
ILE A 306
None
1.00A 4r21B-3szeA:
undetectable
4r21B-3szeA:
19.00
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.
3umm PHOSPHORIBOSYLFORMYL
GLYCINAMIDINE
SYNTHASE


(Salmonella
enterica)
PF02769
(AIRS_C)
PF13507
(GATase_5)
5 ILE A 655
GLY A 372
ALA A 309
ILE A 316
VAL A 333
None
None
None
None
ADP  A2005 ( 4.2A)
0.98A 4r21B-3ummA:
undetectable
4r21B-3ummA:
17.84
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.
3vtz GLUCOSE
1-DEHYDROGENASE


(Thermoplasma
volcanium)
PF13561
(adh_short_C2)
5 ALA A 227
ILE A 122
VAL A 118
ALA A   9
ILE A 128
None
0.98A 4r21B-3vtzA:
undetectable
4r21B-3vtzA:
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.
4ej0 ADP-L-GLYCERO-D-MANN
O-HEPTOSE-6-EPIMERAS
E


(Burkholderia
thailandensis)
PF01370
(Epimerase)
5 ALA A  30
ILE A  12
GLY A  10
ALA A   9
ILE A  48
None
NAP  A 401 (-3.9A)
NAP  A 401 (-3.3A)
None
None
0.98A 4r21B-4ej0A:
undetectable
4r21B-4ej0A:
20.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4f9o HEXOKINASE-1

(Homo sapiens)
PF00349
(Hexokinase_1)
PF03727
(Hexokinase_2)
5 VAL A 659
GLY A 900
ALA A 902
THR A 905
VAL A 655
None
1.05A 4r21B-4f9oA:
undetectable
4r21B-4f9oA:
19.35
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.
4ha6 PYRIDOXINE 4-OXIDASE

(Mesorhizobium
loti)
PF00732
(GMC_oxred_N)
PF05199
(GMC_oxred_C)
5 VAL A 491
GLY A 268
ALA A 269
THR A 466
ILE A 505
None
FAD  A 601 (-3.6A)
None
None
FAD  A 601 (-4.4A)
1.09A 4r21B-4ha6A:
undetectable
4r21B-4ha6A:
23.06
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.
4i6n UBIQUITIN
CARBOXYL-HYDROLASE


(Trichinella
spiralis)
PF01088
(Peptidase_C12)
5 ALA A 198
ILE A 222
VAL A  30
GLY A  48
ILE A 202
None
1.04A 4r21B-4i6nA:
undetectable
4r21B-4i6nA:
20.79
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.
4ig7 UBIQUITIN C-TERMINAL
HYDROLASE 37


(Trichinella
spiralis)
PF01088
(Peptidase_C12)
5 ALA A 198
ILE A 222
VAL A  30
GLY A  48
ILE A 202
None
1.05A 4r21B-4ig7A:
undetectable
4r21B-4ig7A:
21.22
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.
4igd MANNAN-BINDING
LECTIN SERINE
PROTEASE 1


(Homo sapiens)
PF00084
(Sushi)
PF00089
(Trypsin)
5 ALA A 643
ILE A 463
GLY A 648
ILE A 606
VAL A 651
None
0.84A 4r21B-4igdA:
undetectable
4r21B-4igdA:
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.
4ivn TRANSCRIPTIONAL
REGULATOR


(Vibrio
vulnificus)
PF01380
(SIS)
PF01418
(HTH_6)
5 ILE A 140
VAL A 141
GLY A 235
ALA A 236
SER A 104
None
None
BMX  A1000 ( 4.7A)
None
None
0.92A 4r21B-4ivnA:
undetectable
4r21B-4ivnA:
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.
4jig DEHYDROGENASE

(Burkholderia
cenocepacia)
PF13561
(adh_short_C2)
5 ALA A  45
VAL A  66
GLY A  14
ALA A  15
ILE A  61
None
None
ACT  A 301 ( 4.8A)
None
None
0.99A 4r21B-4jigA:
undetectable
4r21B-4jigA:
21.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4jlv C-TERMINAL FRAGMENT
OF MEMBRANE PROTEIN
CAPA1, PUTATIVE
UNCHARACTERIZED
PROTEIN CAPB1


(Staphylococcus
aureus)
PF13614
(AAA_31)
5 ALA A1196
ILE A 200
THR A1047
SER A1177
VAL A1208
None
1.08A 4r21B-4jlvA:
undetectable
4r21B-4jlvA:
18.89
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.
4jnq THIOREDOXIN
REDUCTASE


(Brucella
melitensis)
PF07992
(Pyr_redox_2)
5 ILE A 208
GLY A 223
ALA A 238
SER A 171
VAL A 150
None
1.06A 4r21B-4jnqA:
undetectable
4r21B-4jnqA:
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.
4jrm 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 2


(Vibrio cholerae)
no annotation 6 ALA D 191
VAL D 240
GLY D  12
ALA D  81
ILE D 143
VAL D 187
None
1.33A 4r21B-4jrmD:
undetectable
4r21B-4jrmD:
22.68
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.
4k2x POLYKETIDE
OXYGENASE/HYDROXYLAS
E


(Streptomyces
rimosus)
PF01494
(FAD_binding_3)
5 ALA A 275
GLY A 287
ALA A 289
ILE A 167
VAL A 152
None
FAD  A 601 (-3.5A)
None
None
None
1.08A 4r21B-4k2xA:
undetectable
4r21B-4k2xA:
23.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4k5r OXYGENASE

(Streptomyces
argillaceus)
PF01494
(FAD_binding_3)
5 ALA A 279
GLY A 291
ALA A 293
ILE A 178
VAL A 163
None
FAD  A 601 (-3.5A)
None
None
None
1.06A 4r21B-4k5rA:
undetectable
4r21B-4k5rA:
22.30
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.
4lbw ELONGATION FACTOR
TU-A


(Thermus
thermophilus)
PF00009
(GTP_EFTU)
PF03143
(GTP_EFTU_D3)
PF03144
(GTP_EFTU_D2)
5 ALA A 123
GLY A  15
ALA A 102
ILE A 120
VAL A 105
None
1.06A 4r21B-4lbwA:
undetectable
4r21B-4lbwA:
21.75
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4nky STEROID
17-ALPHA-HYDROXYLASE
/17,20 LYASE


(Homo sapiens)
PF00067
(p450)
5 ALA A 113
GLY A 301
ALA A 302
ILE A 371
VAL A 483
HEM  A 600 ( 2.9A)
3QZ  A 601 ( 3.0A)
3QZ  A 601 (-2.9A)
HEM  A 600 (-3.8A)
3QZ  A 601 (-4.1A)
0.97A 4r21B-4nkyA:
49.1
4r21B-4nkyA:
44.09
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4nky STEROID
17-ALPHA-HYDROXYLASE
/17,20 LYASE


(Homo sapiens)
PF00067
(p450)
6 ALA A 113
ILE A 205
GLY A 301
ALA A 302
THR A 306
ILE A 371
HEM  A 600 ( 2.9A)
3QZ  A 601 ( 3.4A)
3QZ  A 601 ( 3.0A)
3QZ  A 601 (-2.9A)
HEM  A 600 ( 3.2A)
HEM  A 600 (-3.8A)
0.89A 4r21B-4nkyA:
49.1
4r21B-4nkyA:
44.09
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4nky STEROID
17-ALPHA-HYDROXYLASE
/17,20 LYASE


(Homo sapiens)
PF00067
(p450)
5 ILE A 205
GLY A 301
ALA A 302
THR A 306
VAL A 482
3QZ  A 601 ( 3.4A)
3QZ  A 601 ( 3.0A)
3QZ  A 601 (-2.9A)
HEM  A 600 ( 3.2A)
3QZ  A 601 (-4.1A)
0.86A 4r21B-4nkyA:
49.1
4r21B-4nkyA:
44.09
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.
4oal CYTOKININ
DEHYDROGENASE 4


(Zea mays)
PF01565
(FAD_binding_4)
PF09265
(Cytokin-bind)
5 ALA A  84
VAL A 211
GLY A  79
ILE A 521
VAL A 205
None
1.10A 4r21B-4oalA:
undetectable
4r21B-4oalA:
23.44
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.
4r16 418AA LONG
HYPOTHETICAL
UDP-N-ACETYL-D-MANNO
SAMINURONIC ACID
DEHYDROGENASE


(Pyrococcus
horikoshii)
PF00984
(UDPG_MGDP_dh)
PF03720
(UDPG_MGDP_dh_C)
PF03721
(UDPG_MGDP_dh_N)
5 ILE A 168
GLY A 170
ALA A 147
THR A 125
ILE A  80
None
0.96A 4r21B-4r16A:
undetectable
4r21B-4r16A:
22.75
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4r1z CYP17A1 PROTEIN

(Danio rerio)
PF00067
(p450)
7 ALA A 126
ILE A 218
VAL A 219
ALA A 313
THR A 317
SER A 378
ILE A 382
HEM  A 600 (-3.6A)
AER  A 601 ( 4.3A)
None
HEM  A 600 (-3.5A)
HEM  A 600 ( 3.3A)
HEM  A 600 ( 4.6A)
HEM  A 600 ( 4.1A)
1.00A 4r21B-4r1zA:
49.1
4r21B-4r1zA:
46.99
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4r1z CYP17A1 PROTEIN

(Danio rerio)
PF00067
(p450)
7 ALA A 126
ILE A 218
VAL A 219
ALA A 313
THR A 317
SER A 378
VAL A 493
HEM  A 600 (-3.6A)
AER  A 601 ( 4.3A)
None
HEM  A 600 (-3.5A)
HEM  A 600 ( 3.3A)
HEM  A 600 ( 4.6A)
None
1.09A 4r21B-4r1zA:
49.1
4r21B-4r1zA:
46.99
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4r1z CYP17A1 PROTEIN

(Danio rerio)
PF00067
(p450)
6 ALA A 126
VAL A 219
GLY A 312
ALA A 313
THR A 317
ILE A 382
HEM  A 600 (-3.6A)
None
AER  A 601 ( 3.7A)
HEM  A 600 (-3.5A)
HEM  A 600 ( 3.3A)
HEM  A 600 ( 4.1A)
1.16A 4r21B-4r1zA:
49.1
4r21B-4r1zA:
46.99
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4r1z CYP17A1 PROTEIN

(Danio rerio)
PF00067
(p450)
6 ALA A 126
VAL A 219
GLY A 312
ALA A 313
THR A 317
VAL A 493
HEM  A 600 (-3.6A)
None
AER  A 601 ( 3.7A)
HEM  A 600 (-3.5A)
HEM  A 600 ( 3.3A)
None
1.21A 4r21B-4r1zA:
49.1
4r21B-4r1zA:
46.99
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4r20 CYTOCHROME P450
FAMILY 17
POLYPEPTIDE 2


(Danio rerio)
PF00067
(p450)
5 ALA A 120
GLY A 301
ALA A 302
ILE A 371
VAL A 481
AER  A 602 (-3.7A)
AER  A 602 ( 3.8A)
HEM  A 601 (-3.4A)
HEM  A 601 ( 4.9A)
None
0.99A 4r21B-4r20A:
59.5
4r21B-4r20A:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4r20 CYTOCHROME P450
FAMILY 17
POLYPEPTIDE 2


(Danio rerio)
PF00067
(p450)
9 ALA A 120
ILE A 212
VAL A 213
GLY A 301
ALA A 302
THR A 306
SER A 367
ILE A 371
VAL A 480
AER  A 602 (-3.7A)
AER  A 602 (-3.2A)
None
AER  A 602 ( 3.8A)
HEM  A 601 (-3.4A)
HEM  A 601 ( 3.3A)
AER  A 602 (-3.5A)
HEM  A 601 ( 4.9A)
AER  A 602 ( 4.9A)
0.76A 4r21B-4r20A:
59.5
4r21B-4r20A:
100.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4s38 4-HYDROXY-3-METHYLBU
T-2-EN-1-YL
DIPHOSPHATE SYNTHASE


(Thermus
thermophilus)
PF04551
(GcpE)
5 ALA A 369
VAL A 294
GLY A 357
ILE A 386
VAL A 315
None
MES  A 902 (-4.2A)
None
None
None
1.06A 4r21B-4s38A:
undetectable
4r21B-4s38A:
21.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4u9i PERIPLASMIC [NIFE]
HYDROGENASE LARGE
SUBUNIT
PERIPLASMIC [NIFE]
HYDROGENASE SMALL
SUBUNIT


(Desulfovibrio
vulgaris)
PF00374
(NiFeSe_Hases)
PF01058
(Oxidored_q6)
PF14720
(NiFe_hyd_SSU_C)
5 ALA L 249
GLY S 246
ALA S 245
ILE L 111
VAL L 240
None
0.83A 4r21B-4u9iL:
undetectable
4r21B-4u9iL:
21.86
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.
4uoz BETA-GALACTOSIDASE

(Bifidobacterium
animalis)
PF02449
(Glyco_hydro_42)
PF08532
(Glyco_hydro_42M)
PF08533
(Glyco_hydro_42C)
6 ALA A 605
ILE A 524
VAL A 527
THR A 571
ILE A 604
VAL A 601
None
1.47A 4r21B-4uozA:
undetectable
4r21B-4uozA:
21.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4wvm STONUSTOXIN SUBUNIT
ALPHA


(Synanceia
horrida)
PF00622
(SPRY)
PF13765
(PRY)
5 ALA A 481
VAL A 452
GLY A 489
ILE A 298
VAL A 370
None
1.06A 4r21B-4wvmA:
3.4
4r21B-4wvmA:
21.33
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.
4yhx RIBOSOMAL PROTEIN
3/HOMING
ENDONUCLEASE-LIKE
FUSION PROTEIN


(Grosmannia
penicillata)
PF00961
(LAGLIDADG_1)
5 ALA A  16
VAL A  86
THR A  60
ILE A  44
VAL A  63
None
1.10A 4r21B-4yhxA:
undetectable
4r21B-4yhxA:
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.
4ynn PROTEASE DO

(Legionella
pneumophila)
PF13180
(PDZ_2)
PF13365
(Trypsin_2)
5 ILE A  21
GLY A 192
ALA A 190
SER A  62
ILE A  83
None
1.05A 4r21B-4ynnA:
undetectable
4r21B-4ynnA:
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.
4z42 UREASE SUBUNIT ALPHA

(Yersinia
enterocolitica)
PF00449
(Urease_alpha)
PF01979
(Amidohydro_1)
5 ILE C  91
VAL C  71
GLY C  98
THR C 112
ILE C  85
None
1.03A 4r21B-4z42C:
undetectable
4r21B-4z42C:
22.58
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.
5anb EUKARYOTIC
TRANSLATION
INITIATION FACTOR 6


(Dictyostelium
discoideum)
PF01912
(eIF-6)
5 VAL I  92
GLY I  65
ALA I  64
ILE I  97
VAL I  94
None
1.09A 4r21B-5anbI:
undetectable
4r21B-5anbI:
21.26
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.
5bqk ICP27

(Human
alphaherpesvirus
1)
PF05459
(Herpes_UL69)
5 ALA A 426
ILE A 495
VAL A 496
THR A 478
ILE A 425
None
1.10A 4r21B-5bqkA:
undetectable
4r21B-5bqkA:
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.
5bsh PYRROLINE-5-CARBOXYL
ATE REDUCTASE


(Medicago
truncatula)
PF03807
(F420_oxidored)
PF14748
(P5CR_dimer)
5 ALA A  26
ILE A  44
GLY A  17
SER A  72
ILE A  40
None
1.08A 4r21B-5bshA:
2.5
4r21B-5bshA:
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.
5ds0 PEPTIDASE M42

(Thaumarchaeota
archaeon SCGC
AB-539-E09)
PF05343
(Peptidase_M42)
5 ALA A 221
GLY A  65
ALA A  64
SER A 314
VAL A 316
None
1.07A 4r21B-5ds0A:
undetectable
4r21B-5ds0A:
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.
5f38 ACETYL-COA
ACETYLTRANSFERASE


(Escherichia
coli)
PF00108
(Thiolase_N)
PF02803
(Thiolase_C)
5 ALA B 112
ILE B 386
GLY B 355
ALA B 356
ILE B 259
None
MLY  B  86 ( 4.8A)
CSX  B  88 ( 4.3A)
None
None
1.04A 4r21B-5f38B:
undetectable
4r21B-5f38B:
21.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5g0a TRANSAMINASE

(Bacillus
megaterium)
PF00202
(Aminotran_3)
5 GLY A 154
ALA A 155
THR A 159
ILE A 267
VAL A 189
None
1.00A 4r21B-5g0aA:
undetectable
4r21B-5g0aA:
21.86
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.
5gk2 KETOSYNTHASE STLD

(Photorhabdus
laumondii)
PF08541
(ACP_syn_III_C)
5 ALA A  91
ILE A 215
ALA A 148
THR A 145
ILE A 120
None
1.08A 4r21B-5gk2A:
undetectable
4r21B-5gk2A:
23.51
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.
5gq0 EPITHIOSPECIFIER
PROTEIN


(Arabidopsis
thaliana)
no annotation 5 ILE B 255
VAL B 249
GLY B 316
ALA B 309
ILE B  28
None
1.10A 4r21B-5gq0B:
undetectable
4r21B-5gq0B:
22.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5i20 UNCHARACTERIZED
PROTEIN


(Starkeya
novella)
PF00892
(EamA)
5 ALA A 246
GLY A 277
ALA A 278
THR A 282
ILE A  14
None
None
None
OLC  A 302 ( 4.4A)
None
0.93A 4r21B-5i20A:
undetectable
4r21B-5i20A:
21.70
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.
5jk7 URACIL-DNA
GLYCOSYLASE


(Homo sapiens)
PF03167
(UDG)
5 ILE D 141
VAL D 140
GLY D 143
ALA D 205
THR D 226
None
1.09A 4r21B-5jk7D:
undetectable
4r21B-5jk7D:
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.
5jm7 AEROBACTIN SYNTHASE
IUCA


(Klebsiella
pneumoniae)
PF04183
(IucA_IucC)
PF06276
(FhuF)
5 VAL A 292
GLY A 330
ALA A 329
ILE A 275
VAL A 295
None
1.08A 4r21B-5jm7A:
undetectable
4r21B-5jm7A:
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.
5m41 NIGRITOXINE

(Vibrio
nigripulchritudo)
no annotation 5 ALA A 255
ILE A 438
GLY A 359
ILE A 247
VAL A 328
None
1.00A 4r21B-5m41A:
undetectable
4r21B-5m41A:
9.66
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.
5nd1 CAPSID PROTEIN

(Rosellinia
necatrix
quadrivirus 1)
no annotation 5 ALA B 439
ILE B 487
THR B 225
ILE B 159
VAL B 232
None
1.06A 4r21B-5nd1B:
undetectable
4r21B-5nd1B:
10.83
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.
5t8d I-ONUI_E-VHIVINT_V2

(synthetic
construct)
PF00961
(LAGLIDADG_1)
5 ALA A  19
VAL A  89
THR A  63
ILE A  47
VAL A  66
None
1.07A 4r21B-5t8dA:
undetectable
4r21B-5t8dA:
19.16
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.
5w76 ANCESTRAL ELOGATION
FACTOR N153


(synthetic
construct)
no annotation 5 ALA A 123
GLY A  16
ALA A 102
ILE A 120
VAL A 105
None
1.07A 4r21B-5w76A:
undetectable
4r21B-5w76A:
8.97
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.
5w7q CONSENSUS ELONGATION
FACTOR


(synthetic
construct)
no annotation 5 ALA A 123
GLY A  16
ALA A 102
ILE A 120
VAL A 105
None
1.01A 4r21B-5w7qA:
undetectable
4r21B-5w7qA:
9.26
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.
5xdy HEAT SHOCK PROTEIN
HTRA


(Mycobacterium
tuberculosis)
no annotation 5 ALA A 308
ILE A 258
GLY A 256
SER A 245
VAL A 286
None
1.06A 4r21B-5xdyA:
undetectable
4r21B-5xdyA:
12.14
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.
5xgv PYRE3

(Streptomyces
rugosporus)
no annotation 5 ALA A 262
GLY A 274
ALA A 276
ILE A 162
VAL A 147
None
FAD  A 501 (-3.5A)
None
None
None
1.04A 4r21B-5xgvA:
undetectable
4r21B-5xgvA:
14.85
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.
5zya SPLICING FACTOR 3B
SUBUNIT 1


(Homo sapiens)
no annotation 5 ALA C 745
ILE C 690
VAL C 687
ALA C 710
VAL C 727
None
1.01A 4r21B-5zyaC:
undetectable
4r21B-5zyaC:
9.81
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.
6b82 CYTOCHROME P450,
FAMILY 17, SUBFAMILY
A, POLYPEPTIDE 1


(Danio rerio)
no annotation 6 ALA A 126
ILE A 218
GLY A 312
ALA A 313
THR A 317
SER A 378
HEM  A 601 (-3.8A)
AER  A 602 (-3.9A)
AER  A 602 ( 3.7A)
HEM  A 601 (-3.6A)
HEM  A 601 ( 3.7A)
AER  A 602 (-3.2A)
1.15A 4r21B-6b82A:
46.9
4r21B-6b82A:
9.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6b82 CYTOCHROME P450,
FAMILY 17, SUBFAMILY
A, POLYPEPTIDE 1


(Danio rerio)
no annotation 6 ALA A 126
ILE A 218
GLY A 312
THR A 317
SER A 378
ILE A 382
HEM  A 601 (-3.8A)
AER  A 602 (-3.9A)
AER  A 602 ( 3.7A)
HEM  A 601 ( 3.7A)
AER  A 602 (-3.2A)
None
1.08A 4r21B-6b82A:
46.9
4r21B-6b82A:
9.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6b82 CYTOCHROME P450,
FAMILY 17, SUBFAMILY
A, POLYPEPTIDE 1


(Danio rerio)
no annotation 6 ALA A 126
ILE A 218
VAL A 219
GLY A 312
ALA A 313
THR A 317
HEM  A 601 (-3.8A)
AER  A 602 (-3.9A)
AER  A 602 (-4.8A)
AER  A 602 ( 3.7A)
HEM  A 601 (-3.6A)
HEM  A 601 ( 3.7A)
1.19A 4r21B-6b82A:
46.9
4r21B-6b82A:
9.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6b82 CYTOCHROME P450,
FAMILY 17, SUBFAMILY
A, POLYPEPTIDE 1


(Danio rerio)
no annotation 5 ILE A 218
VAL A 219
ALA A 313
THR A 317
VAL A 493
AER  A 602 (-3.9A)
AER  A 602 (-4.8A)
HEM  A 601 (-3.6A)
HEM  A 601 ( 3.7A)
AER  A 602 ( 4.7A)
0.81A 4r21B-6b82A:
46.9
4r21B-6b82A:
9.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6en4 SPLICING FACTOR 3B
SUBUNIT 1


(Homo sapiens)
no annotation 5 ALA C 745
ILE C 690
VAL C 687
ALA C 710
VAL C 727
None
1.08A 4r21B-6en4C:
undetectable
4r21B-6en4C:
11.93
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.
6gbh HOPQ

(Helicobacter
pylori)
no annotation 5 ALA C 227
ILE C 347
ALA C  90
ILE C 165
VAL C 380
None
0.92A 4r21B-6gbhC:
undetectable
4r21B-6gbhC:
9.28