SIMILAR PATTERNS OF AMINO ACIDS FOR 3KPC_A_SAMA1000

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.
1a3y ODORANT BINDING
PROTEIN


(Sus scrofa)
PF00061
(Lipocalin)
5 ILE A  29
VAL A 147
ILE A 146
ASN A 139
SER A  24
None
1.08A 3kpcA-1a3yA:
0.0
3kpcA-1a3yA:
21.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1elj MALTODEXTRIN-BINDING
PROTEIN


(Pyrococcus
furiosus)
PF13416
(SBP_bac_8)
5 ASP A 319
VAL A 244
ILE A 121
ASN A 233
ILE A 232
None
1.19A 3kpcA-1eljA:
0.0
3kpcA-1eljA:
17.18
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.
1icp 12-OXOPHYTODIENOATE
REDUCTASE 1


(Solanum
lycopersicum)
PF00724
(Oxidored_FMN)
5 ILE A 130
THR A  74
ILE A 162
ASN A 167
ILE A 165
None
1.22A 3kpcA-1icpA:
0.0
3kpcA-1icpA:
17.66
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.
1ldm M4 LACTATE
DEHYDROGENASE


(Squalus
acanthias)
PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C)
5 THR A  24
VAL A  93
ILE A  94
ASN A 123
ILE A 124
None
1.19A 3kpcA-1ldmA:
0.0
3kpcA-1ldmA:
17.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1mab PROTEIN (F1-ATPASE
BETA CHAIN)


(Rattus
norvegicus)
PF00006
(ATP-synt_ab)
PF02874
(ATP-synt_ab_N)
5 ILE B 108
THR B  90
THR B 110
ILE B  84
PRO B 101
None
1.19A 3kpcA-1mabB:
undetectable
3kpcA-1mabB:
17.05
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.
1ohe CDC14B2 PHOSPHATASE

(Homo sapiens)
PF00782
(DSPc)
PF14671
(DSPn)
5 ILE A  52
THR A  53
ILE A 118
ASN A 105
ILE A 104
None
1.04A 3kpcA-1oheA:
undetectable
3kpcA-1oheA:
18.91
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.
1rkx CDP-GLUCOSE-4,6-DEHY
DRATASE


(Yersinia
pseudotuberculosis)
PF16363
(GDP_Man_Dehyd)
5 ILE A 197
THR A 325
ILE A 207
ASN A 274
ILE A 275
None
1.20A 3kpcA-1rkxA:
undetectable
3kpcA-1rkxA:
16.07
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.
1rrh SEED LIPOXYGENASE-3

(Glycine max)
PF00305
(Lipoxygenase)
PF01477
(PLAT)
5 ILE A  12
ILE A 111
ASN A 164
ILE A 141
SER A 140
None
1.14A 3kpcA-1rrhA:
undetectable
3kpcA-1rrhA:
9.95
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.
1tis THYMIDYLATE SYNTHASE

(Escherichia
virus T4)
PF00303
(Thymidylat_synt)
5 ILE A 197
THR A 193
TRP A  52
VAL A 261
ILE A  60
None
0.87A 3kpcA-1tisA:
undetectable
3kpcA-1tisA:
17.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ugh PROTEIN (URACIL-DNA
GLYCOSYLASE
INHIBITOR)


(Bacillus phage
PBS2)
no annotation 5 ILE I  41
THR I  59
VAL I  29
ILE I  33
PRO I  37
None
1.22A 3kpcA-1ughI:
undetectable
3kpcA-1ughI:
24.17
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.
1v8b ADENOSYLHOMOCYSTEINA
SE


(Plasmodium
falciparum)
PF00670
(AdoHcyase_NAD)
PF05221
(AdoHcyase)
5 ILE A 131
THR A 139
ILE A 195
ASN A 428
PRO A 128
None
1.21A 3kpcA-1v8bA:
undetectable
3kpcA-1v8bA:
13.32
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.
1xkf HYPOTHETICAL PROTEIN
RV2626C


(Mycobacterium
tuberculosis)
PF00571
(CBS)
6 ILE A 113
THR A 115
ASP A 118
VAL A  12
ILE A  33
PRO A  37
None
0.94A 3kpcA-1xkfA:
16.7
3kpcA-1xkfA:
29.29
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.
1xq1 PUTATIVE TROPINONE
REDUCATSE


(Arabidopsis
thaliana)
PF13561
(adh_short_C2)
5 ILE A  41
THR A  43
VAL A  31
ILE A  30
ASN A  98
None
1.22A 3kpcA-1xq1A:
undetectable
3kpcA-1xq1A:
19.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1xq1 PUTATIVE TROPINONE
REDUCATSE


(Arabidopsis
thaliana)
PF13561
(adh_short_C2)
5 ILE A  41
VAL A  31
ILE A  30
ASN A  98
ILE A  97
None
1.09A 3kpcA-1xq1A:
undetectable
3kpcA-1xq1A:
19.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1yv7 P-30 PROTEIN

(Rana pipiens)
PF00074
(RnaseA)
5 ILE A  47
THR A  59
VAL A  88
ILE A  37
PRO A  95
None
1.16A 3kpcA-1yv7A:
undetectable
3kpcA-1yv7A:
23.02
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.
1zfj INOSINE
MONOPHOSPHATE
DEHYDROGENASE


(Streptococcus
pyogenes)
PF00478
(IMPDH)
PF00571
(CBS)
5 ILE A 139
THR A 141
ASP A 144
THR A 160
PRO A 189
None
0.86A 3kpcA-1zfjA:
15.5
3kpcA-1zfjA:
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.
2b4v RNA EDITING COMPLEX
PROTEIN MP57


(Trypanosoma
brucei)
PF01909
(NTP_transf_2)
PF03828
(PAP_assoc)
5 VAL A 323
ILE A 326
ILE A 281
SER A 278
PRO A 422
None
1.22A 3kpcA-2b4vA:
undetectable
3kpcA-2b4vA:
14.07
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.
2b5u COLICIN E3

(Escherichia
coli)
PF03515
(Cloacin)
PF09000
(Cytotoxic)
PF11570
(E2R135)
5 THR A 267
VAL A 287
ILE A 155
ASN A 195
ILE A 196
None
1.24A 3kpcA-2b5uA:
undetectable
3kpcA-2b5uA:
13.47
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.
2cod CENTAURIN-DELTA 1

(Homo sapiens)
PF00169
(PH)
5 ILE A  57
THR A  72
VAL A  70
ILE A  37
SER A  36
None
1.26A 3kpcA-2codA:
undetectable
3kpcA-2codA:
19.70
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2ef7 HYPOTHETICAL PROTEIN
ST2348


(Sulfurisphaera
tokodaii)
PF00571
(CBS)
5 ILE A  49
THR A  51
ASP A  54
THR A  74
ILE A  98
None
0.66A 3kpcA-2ef7A:
14.8
3kpcA-2ef7A:
33.58
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.
2f1f ACETOLACTATE
SYNTHASE ISOZYME III
SMALL SUBUNIT


(Escherichia
coli)
PF10369
(ALS_ss_C)
PF13710
(ACT_5)
5 VAL A  19
ILE A  20
ASN A  29
ILE A  30
SER A  32
None
1.27A 3kpcA-2f1fA:
undetectable
3kpcA-2f1fA:
23.03
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.
2gwg 4-OXALOMESACONATE
HYDRATASE


(Rhodopseudomonas
palustris)
PF04909
(Amidohydro_2)
5 ILE A 274
ILE A 221
ASN A 254
ILE A 255
PRO A 229
None
1.19A 3kpcA-2gwgA:
undetectable
3kpcA-2gwgA:
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.
2j9l CHLORIDE CHANNEL
PROTEIN 5


(Homo sapiens)
PF00571
(CBS)
5 ILE A 722
THR A 724
ASP A 727
SER A 618
PRO A 621
ATP  A1752 (-4.1A)
ATP  A1752 (-2.7A)
ATP  A1752 (-2.7A)
ATP  A1752 (-3.3A)
None
0.61A 3kpcA-2j9lA:
13.0
3kpcA-2j9lA:
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.
2kca BACTERIOPHAGE SPP1
COMPLETE NUCLEOTIDE
SEQUENCE


(Bacillus phage
SPP1)
PF05521
(Phage_H_T_join)
5 ILE A 102
THR A  96
ASP A  99
VAL A 108
ILE A  43
None
1.27A 3kpcA-2kcaA:
undetectable
3kpcA-2kcaA:
23.66
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.
2lcq PUTATIVE TOXIN VAPC6

(Pyrococcus
horikoshii)
PF17146
(PIN_6)
5 THR A  72
VAL A  68
ILE A  65
ASN A 102
ILE A 106
None
1.20A 3kpcA-2lcqA:
undetectable
3kpcA-2lcqA:
21.18
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.
2o16 ACETOIN UTILIZATION
PROTEIN ACUB,
PUTATIVE


(Vibrio cholerae)
PF00571
(CBS)
6 ILE A 139
THR A 141
ASP A 144
THR A  28
ILE A  52
PRO A  56
None
PO4  A   1 (-3.0A)
None
None
PO4  A   1 (-4.4A)
None
0.82A 3kpcA-2o16A:
18.8
3kpcA-2o16A:
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.
2oox HYPOTHETICAL PROTEIN
C1556.08C IN
CHROMOSOME I


(Schizosaccharomyces
pombe)
no annotation 7 ILE G 303
ASP G 308
THR G 191
ASN G 215
ILE G 216
SER G 217
PRO G 220
AMP  G 401 (-4.0A)
AMP  G 401 (-2.6A)
AMP  G 401 (-3.7A)
None
AMP  G 401 (-3.7A)
AMP  G 401 (-2.3A)
AMP  G 401 (-4.7A)
0.87A 3kpcA-2ooxG:
12.1
3kpcA-2ooxG:
20.07
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.
2oux MAGNESIUM
TRANSPORTER


(Enterococcus
faecalis)
PF00571
(CBS)
PF03448
(MgtE_N)
5 VAL A 155
ILE A 202
ASN A 207
ILE A 188
SER A 189
None
1.18A 3kpcA-2ouxA:
15.4
3kpcA-2ouxA:
17.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2p9m HYPOTHETICAL PROTEIN
MJ0922


(Methanocaldococcus
jannaschii)
PF00571
(CBS)
6 ILE A  54
THR A  56
VAL A  83
ILE A  84
ILE A 109
PRO A 113
None
0.66A 3kpcA-2p9mA:
18.4
3kpcA-2p9mA:
37.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2p9m HYPOTHETICAL PROTEIN
MJ0922


(Methanocaldococcus
jannaschii)
PF00571
(CBS)
5 ILE A 124
ASP A 129
THR A  15
ILE A  39
PRO A  43
None
1.05A 3kpcA-2p9mA:
18.4
3kpcA-2p9mA:
37.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2p9m HYPOTHETICAL PROTEIN
MJ0922


(Methanocaldococcus
jannaschii)
PF00571
(CBS)
7 ILE A 124
ASP A 129
THR A  15
VAL A  18
ILE A  19
SER A  40
PRO A  43
None
0.84A 3kpcA-2p9mA:
18.4
3kpcA-2p9mA:
37.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2p9m HYPOTHETICAL PROTEIN
MJ0922


(Methanocaldococcus
jannaschii)
PF00571
(CBS)
6 ILE A 124
VAL A  18
ILE A  19
ILE A  39
SER A  40
PRO A  43
None
1.00A 3kpcA-2p9mA:
18.4
3kpcA-2p9mA:
37.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2p9m HYPOTHETICAL PROTEIN
MJ0922


(Methanocaldococcus
jannaschii)
PF00571
(CBS)
5 THR A  56
ASP A  59
ILE A  84
ILE A 109
PRO A 113
None
1.05A 3kpcA-2p9mA:
18.4
3kpcA-2p9mA:
37.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2p9m HYPOTHETICAL PROTEIN
MJ0922


(Methanocaldococcus
jannaschii)
PF00571
(CBS)
6 THR A  56
THR A  80
VAL A  83
ILE A  84
ILE A 109
PRO A 113
None
0.79A 3kpcA-2p9mA:
18.4
3kpcA-2p9mA:
37.59
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.
2q1d 2-KETO-3-DEOXY-D-ARA
BINONATE DEHYDRATASE


(Sulfolobus
solfataricus)
PF01557
(FAA_hydrolase)
5 ILE X 251
THR X 160
THR X 253
VAL X  76
PRO X  73
None
1.18A 3kpcA-2q1dX:
undetectable
3kpcA-2q1dX:
22.31
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.
2rc3 CBS DOMAIN

(Nitrosomonas
europaea)
PF00571
(CBS)
6 ILE A  72
THR A  74
ASP A  77
THR A  99
VAL A 102
PRO A 127
None
BR  A 171 (-4.0A)
None
BR  A 177 ( 4.2A)
None
None
0.64A 3kpcA-2rc3A:
18.2
3kpcA-2rc3A:
29.29
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.
2vbf BRANCHED-CHAIN
ALPHA-KETOACID
DECARBOXYLASE


(Lactococcus
lactis)
PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N)
5 ILE A 396
THR A  62
VAL A 374
ILE A 373
ASN A 370
ILE  A 396 ( 0.7A)
THR  A  62 ( 0.8A)
VAL  A 374 ( 0.5A)
ILE  A 373 ( 0.7A)
ASN  A 370 ( 0.6A)
1.25A 3kpcA-2vbfA:
undetectable
3kpcA-2vbfA:
12.79
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.
2yzq PUTATIVE
UNCHARACTERIZED
PROTEIN PH1780


(Pyrococcus
horikoshii)
PF00571
(CBS)
5 ILE A 106
THR A 108
ASP A 111
THR A   8
PRO A  36
None
0.69A 3kpcA-2yzqA:
16.8
3kpcA-2yzqA:
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.
2yzq PUTATIVE
UNCHARACTERIZED
PROTEIN PH1780


(Pyrococcus
horikoshii)
PF00571
(CBS)
7 ILE A 172
ASP A 177
THR A 228
VAL A 231
ILE A 232
ILE A 252
PRO A 256
SAM  A6075 (-3.9A)
SAM  A6075 (-2.8A)
SAM  A6075 (-3.5A)
SAM  A6075 (-3.8A)
SAM  A6075 (-3.9A)
SAM  A6075 (-3.6A)
SAM  A6075 (-4.6A)
0.59A 3kpcA-2yzqA:
16.8
3kpcA-2yzqA:
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.
3b3l KETOHEXOKINASE

(Homo sapiens)
PF00294
(PfkB)
5 ILE A  17
ASP A 252
ILE A 100
ASN A 103
SER A  34
None
1.16A 3kpcA-3b3lA:
undetectable
3kpcA-3b3lA:
18.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ddj CBS
DOMAIN-CONTAINING
PROTEIN


(Sulfolobus
solfataricus)
PF00571
(CBS)
5 ILE A 254
THR A 256
ASP A 259
VAL A 147
PRO A 172
AMP  A 278 ( 4.5A)
AMP  A 278 (-3.1A)
AMP  A 278 (-2.7A)
AMP  A 278 ( 3.6A)
AMP  A 278 (-4.7A)
0.30A 3kpcA-3ddjA:
13.6
3kpcA-3ddjA:
16.72
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.
3ddj CBS
DOMAIN-CONTAINING
PROTEIN


(Sulfolobus
solfataricus)
PF00571
(CBS)
5 THR A  47
ASP A  50
THR A  81
ASN A 104
PRO A 109
PEG  A 279 (-4.4A)
None
None
None
None
0.88A 3kpcA-3ddjA:
13.6
3kpcA-3ddjA:
16.72
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.
3ec2 DNA REPLICATION
PROTEIN DNAC


(Aquifex
aeolicus)
PF01695
(IstB_IS21)
5 ILE A 103
THR A  99
VAL A  71
ASN A 215
SER A 176
None
1.14A 3kpcA-3ec2A:
undetectable
3kpcA-3ec2A:
23.81
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.
3fhm UNCHARACTERIZED
PROTEIN ATU1752


(Agrobacterium
fabrum)
PF00571
(CBS)
6 ILE A  52
THR A  54
ASP A  57
THR A  79
VAL A  82
PRO A 107
AMP  A 200 (-4.0A)
AMP  A 200 (-2.9A)
AMP  A 200 (-2.9A)
AMP  A 200 (-3.5A)
AMP  A 200 ( 4.3A)
AMP  A 200 (-4.7A)
0.49A 3kpcA-3fhmA:
17.6
3kpcA-3fhmA:
23.64
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.
3g1u ADENOSYLHOMOCYSTEINA
SE


(Leishmania
major)
PF00670
(AdoHcyase_NAD)
PF05221
(AdoHcyase)
5 ILE A 139
VAL A 146
ILE A 149
ILE A 127
PRO A 173
None
1.27A 3kpcA-3g1uA:
undetectable
3kpcA-3g1uA:
16.13
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.
3gzt OUTER CAPSID
GLYCOPROTEIN VP7


(Rotavirus A)
PF00434
(VP7)
5 THR B  75
VAL B 303
ILE B 306
ASN B 257
SER B 311
None
1.11A 3kpcA-3gztB:
undetectable
3kpcA-3gztB:
19.14
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.
3k2v PUTATIVE D-ARABINOSE
5-PHOSPHATE
ISOMERASE


(Klebsiella
pneumoniae)
PF00571
(CBS)
5 ILE A 258
THR A 260
ASP A 263
THR A 284
ILE A 288
CMK  A   1 (-4.2A)
CMK  A   1 (-3.4A)
CMK  A   1 (-2.8A)
CMK  A   1 (-3.1A)
CMK  A   1 (-3.7A)
1.09A 3kpcA-3k2vA:
16.5
3kpcA-3k2vA:
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.
3k3q BOTULINUM NEUROTOXIN
TYPE A


(Clostridium
botulinum)
PF01742
(Peptidase_M27)
5 ILE B  45
ASP B  49
ILE B 135
ASN B  26
ILE B  24
None
1.25A 3kpcA-3k3qB:
undetectable
3kpcA-3k3qB:
19.83
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.
3kf8 PROTEIN TEN1

(Candida
tropicalis)
PF12658
(Ten1)
5 ILE B  58
ILE B  82
ASN B  92
ILE B  91
PRO B   8
None
1.12A 3kpcA-3kf8B:
undetectable
3kpcA-3kf8B:
27.54
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.
3kh5 PROTEIN MJ1225

(Methanocaldococcus
jannaschii)
PF00571
(CBS)
6 ILE A  51
THR A  53
ASP A  56
VAL A  94
ASN A 114
PRO A 119
ADP  A 283 ( 4.2A)
ADP  A 283 (-2.7A)
ADP  A 283 (-2.8A)
ADP  A 283 (-3.7A)
ADP  A 284 ( 4.9A)
None
0.47A 3kpcA-3kh5A:
12.7
3kpcA-3kh5A:
24.33
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.
3kh5 PROTEIN MJ1225

(Methanocaldococcus
jannaschii)
PF00571
(CBS)
6 ILE A  51
THR A  53
ASP A  56
VAL A  94
ILE A  95
PRO A 119
ADP  A 283 ( 4.2A)
ADP  A 283 (-2.7A)
ADP  A 283 (-2.8A)
ADP  A 283 (-3.7A)
ADP  A 283 (-3.8A)
None
0.52A 3kpcA-3kh5A:
12.7
3kpcA-3kh5A:
24.33
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.
3kh5 PROTEIN MJ1225

(Methanocaldococcus
jannaschii)
PF00571
(CBS)
7 ILE A 193
THR A 195
ASP A 198
VAL A 233
ILE A 234
ILE A 254
PRO A 258
AMP  A 282 ( 4.3A)
AMP  A 282 (-3.1A)
AMP  A 282 (-3.1A)
AMP  A 282 (-3.8A)
AMP  A 282 (-3.9A)
AMP  A 282 (-4.1A)
None
0.55A 3kpcA-3kh5A:
12.7
3kpcA-3kh5A:
24.33
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.
3kh5 PROTEIN MJ1225

(Methanocaldococcus
jannaschii)
PF00571
(CBS)
5 ILE A 269
THR A 271
ASP A 274
THR A 155
ASN A 114
ADP  A 284 ( 4.3A)
ADP  A 284 (-3.4A)
ADP  A 284 (-2.8A)
ADP  A 284 (-3.2A)
ADP  A 284 ( 4.9A)
1.17A 3kpcA-3kh5A:
12.7
3kpcA-3kh5A:
24.33
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.
3kh5 PROTEIN MJ1225

(Methanocaldococcus
jannaschii)
PF00571
(CBS)
7 ILE A 269
THR A 271
ASP A 274
THR A 155
VAL A 158
ILE A 159
PRO A 183
ADP  A 284 ( 4.3A)
ADP  A 284 (-3.4A)
ADP  A 284 (-2.8A)
ADP  A 284 (-3.2A)
ADP  A 284 (-3.9A)
ADP  A 284 (-4.2A)
None
0.29A 3kpcA-3kh5A:
12.7
3kpcA-3kh5A:
24.33
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3kpb UNCHARACTERIZED
PROTEIN MJ0100


(Methanocaldococcus
jannaschii)
PF00571
(CBS)
10 ILE A 434
THR A 436
ASP A 439
THR A 456
VAL A 459
ILE A 460
ASN A 479
ILE A 480
SER A 481
PRO A 484
SAM  A1000 ( 4.2A)
SAM  A1000 (-3.4A)
SAM  A1000 (-2.6A)
SAM  A1000 (-3.0A)
SAM  A1000 ( 3.9A)
SAM  A1000 (-3.8A)
None
SAM  A1000 (-4.0A)
SAM  A1000 (-3.2A)
None
0.75A 3kpcA-3kpbA:
21.3
3kpcA-3kpbA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3kpb UNCHARACTERIZED
PROTEIN MJ0100


(Methanocaldococcus
jannaschii)
PF00571
(CBS)
7 ILE A 495
THR A 497
ASP A 500
ILE A 399
ASN A 418
ILE A 419
PRO A 423
None
0.79A 3kpcA-3kpbA:
21.3
3kpcA-3kpbA:
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.
3ldh LACTATE
DEHYDROGENASE


(Squalus
acanthias)
PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C)
5 THR A  25
VAL A  95
ILE A  96
ASN A 126
ILE A 127
None
1.26A 3kpcA-3ldhA:
undetectable
3kpcA-3ldhA:
16.82
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.
3ocm PUTATIVE MEMBRANE
PROTEIN


(Bordetella
parapertussis)
PF00571
(CBS)
5 THR A 443
ASP A 446
THR A 339
VAL A 344
PRO A 369
ADP  A 470 (-3.0A)
ADP  A 470 (-2.8A)
ADP  A 470 (-3.6A)
ADP  A 470 ( 4.0A)
None
0.66A 3kpcA-3ocmA:
10.6
3kpcA-3ocmA:
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.
3oop LIN2960 PROTEIN

(Listeria
innocua)
PF01047
(MarR)
5 THR A  58
VAL A  39
ILE A  43
ILE A  49
SER A  50
None
1.20A 3kpcA-3oopA:
undetectable
3kpcA-3oopA:
19.01
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.
3oqp PUTATIVE
ISOCHORISMATASE


(Paraburkholderia
xenovorans)
PF00857
(Isochorismatase)
5 ILE A   9
THR A 125
VAL A  51
ILE A  52
ASN A  55
None
None
None
None
PG4  A 302 (-3.2A)
1.27A 3kpcA-3oqpA:
undetectable
3kpcA-3oqpA:
24.63
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.
3pen TRANSLATION
INITIATION FACTOR 2
SUBUNIT GAMMA


(Sulfolobus
solfataricus)
PF00009
(GTP_EFTU)
PF03144
(GTP_EFTU_D2)
PF09173
(eIF2_C)
5 ILE A 272
THR A 274
ILE A 316
ILE A 238
SER A 220
None
1.20A 3kpcA-3penA:
undetectable
3kpcA-3penA:
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.
3pr2 TRYPTOPHAN SYNTHASE
ALPHA CHAIN


(Salmonella
enterica)
PF00290
(Trp_syntA)
5 ILE A  64
THR A 183
THR A  63
VAL A 238
ILE A 237
None
F9F  A   1 (-3.9A)
None
None
None
1.26A 3kpcA-3pr2A:
undetectable
3kpcA-3pr2A:
18.44
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.
3r0s ACYL-[ACYL-CARRIER-P
ROTEIN]--UDP-N-ACETY
LGLUCOSAMINE
O-ACYLTRANSFERASE


(Campylobacter
jejuni)
PF00132
(Hexapep)
PF13720
(Acetyltransf_11)
5 ILE A  52
THR A  50
ILE A 108
ASN A  96
ILE A  95
None
1.27A 3kpcA-3r0sA:
undetectable
3kpcA-3r0sA:
17.67
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.
3ram HMRA PROTEIN

(Staphylococcus
aureus)
PF01546
(Peptidase_M20)
PF07687
(M20_dimer)
5 ILE A  65
THR A  67
VAL A 145
ILE A 146
ILE A 149
None
1.11A 3kpcA-3ramA:
undetectable
3kpcA-3ramA:
14.68
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.
3tlz MCCF

(Escherichia
coli)
PF02016
(Peptidase_S66)
5 ILE A 107
THR A 131
VAL A  78
ILE A  86
ILE A 114
None
1.25A 3kpcA-3tlzA:
undetectable
3kpcA-3tlzA:
20.13
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.
3tsd INOSINE-5'-MONOPHOSP
HATE DEHYDROGENASE


(Bacillus
anthracis)
PF00478
(IMPDH)
PF00571
(CBS)
6 ILE A 137
THR A 139
ASP A 142
ILE A 163
ILE A 183
PRO A 187
None
0.97A 3kpcA-3tsdA:
14.7
3kpcA-3tsdA:
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.
487d PROTEIN (50S L9
RIBOSOMAL PROTEIN)


(Geobacillus
stearothermophilus)
PF01281
(Ribosomal_L9_N)
PF03948
(Ribosomal_L9_C)
5 ILE K 121
THR K 127
VAL K 145
ILE K  98
SER K  95
None
1.25A 3kpcA-487dK:
undetectable
3kpcA-487dK:
24.86
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.
4acz ENDO-ALPHA-MANNOSIDA
SE


(Bacteroides
thetaiotaomicron)
PF16317
(Glyco_hydro_99)
5 THR B 218
VAL B 172
ILE B 171
ILE B 168
PRO B 188
None
1.24A 3kpcA-4aczB:
undetectable
3kpcA-4aczB:
17.78
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.
4aey D-ERYTHRO-7,8-DIHYDR
ONEOPTERIN
TRIPHOSPHATE
EPIMERASE


(Pseudomonas
aeruginosa)
PF02152
(FolB)
5 ILE A  68
THR A  64
ILE A  86
ASN A  38
ILE A  37
None
1.07A 3kpcA-4aeyA:
undetectable
3kpcA-4aeyA:
22.15
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.
4esy CBS DOMAIN
CONTAINING MEMBRANE
PROTEIN


(Sphaerobacter
thermophilus)
PF00571
(CBS)
5 ILE A 359
ASP A 364
THR A 407
ILE A 431
PRO A 435
None
1.24A 3kpcA-4esyA:
14.0
3kpcA-4esyA:
29.09
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.
4esy CBS DOMAIN
CONTAINING MEMBRANE
PROTEIN


(Sphaerobacter
thermophilus)
PF00571
(CBS)
5 ILE A 359
THR A 361
ASP A 364
THR A 407
ILE A 431
None
1.03A 3kpcA-4esyA:
14.0
3kpcA-4esyA:
29.09
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.
4fry PUTATIVE
SIGNAL-TRANSDUCTION
PROTEIN WITH CBS
DOMAINS


(Burkholderia
ambifaria)
PF00571
(CBS)
6 ILE A  54
THR A  56
ASP A  59
THR A  81
VAL A  84
PRO A 109
AMP  A 202 (-4.1A)
AMP  A 202 (-2.9A)
AMP  A 202 (-2.6A)
AMP  A 202 (-3.6A)
AMP  A 202 (-3.8A)
AMP  A 202 (-4.7A)
0.37A 3kpcA-4fryA:
17.4
3kpcA-4fryA:
28.95
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.
4gnx PUTATIVE
UNCHARACTERIZED
PROTEIN


(Ustilago maydis)
PF01336
(tRNA_anti-codon)
PF08646
(Rep_fac-A_C)
PF16900
(REPA_OB_2)
5 ILE C 255
THR C 282
ILE C 231
ASN C 261
ILE C 276
None
1.12A 3kpcA-4gnxC:
undetectable
3kpcA-4gnxC:
15.05
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.
4iys METAL TRANSPORTER
CNNM2


(Homo sapiens)
PF00571
(CBS)
5 ILE A 566
THR A 568
ASP A 571
THR A 451
PRO A 482
None
0.83A 3kpcA-4iysA:
12.1
3kpcA-4iysA:
22.50
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.
4j9u TRK SYSTEM POTASSIUM
UPTAKE PROTEIN TRKH


(Vibrio
parahaemolyticus)
PF02386
(TrkH)
5 ASP A 454
VAL A 116
ILE A 117
ASN A  95
ILE A  96
None
1.26A 3kpcA-4j9uA:
undetectable
3kpcA-4j9uA:
12.04
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.
4kgk THG1-LIKE
UNCHARACTERIZED
PROTEIN


(Bacillus
thuringiensis)
PF04446
(Thg1)
5 ILE A 100
VAL A  27
ILE A  79
ASN A  63
ILE A  64
None
1.18A 3kpcA-4kgkA:
undetectable
3kpcA-4kgkA:
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.
4lb8 UNCHARACTERIZED
PROTEIN


(Bacteroides
thetaiotaomicron)
PF16140
(DUF4848)
5 ILE A 291
THR A 290
VAL A 308
ILE A 189
SER A 184
None
1.18A 3kpcA-4lb8A:
undetectable
3kpcA-4lb8A:
17.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4nho PROBABLE
ATP-DEPENDENT RNA
HELICASE DDX23


(Homo sapiens)
PF00270
(DEAD)
PF00271
(Helicase_C)
5 THR A 381
VAL A 626
ILE A 431
ILE A 424
PRO A 624
None
1.24A 3kpcA-4nhoA:
undetectable
3kpcA-4nhoA:
16.47
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.
4o9k ARABINOSE
5-PHOSPHATE
ISOMERASE


(Methylococcus
capsulatus)
PF00571
(CBS)
5 THR A 256
ASP A 259
THR A 280
ILE A 304
PRO A 308
CMK  A 401 (-3.4A)
CMK  A 401 (-2.6A)
CMK  A 401 (-3.1A)
CMK  A 401 (-3.5A)
CMK  A 401 (-4.5A)
0.69A 3kpcA-4o9kA:
17.8
3kpcA-4o9kA:
28.47
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.
4p6v NA(+)-TRANSLOCATING
NADH-QUINONE
REDUCTASE SUBUNIT F


(Vibrio cholerae)
PF00111
(Fer2)
PF00175
(NAD_binding_1)
PF00970
(FAD_binding_6)
5 ILE F 279
VAL F 387
ILE F 388
ASN F 400
ILE F 401
None
1.26A 3kpcA-4p6vF:
undetectable
3kpcA-4p6vF:
15.16
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.
4r85 CYTOSINE DEAMINASE

(Klebsiella
pneumoniae)
PF07969
(Amidohydro_3)
5 ILE A  57
THR A  62
THR A 116
VAL A 114
ILE A 103
None
1.26A 3kpcA-4r85A:
undetectable
3kpcA-4r85A:
13.84
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.
4rer 5'-AMP-ACTIVATED
PROTEIN KINASE
SUBUNIT GAMMA-1


(Homo sapiens)
PF00571
(CBS)
5 ILE G 312
ASP G 317
THR G 200
SER G 226
PRO G 229
AMP  G 403 (-3.6A)
AMP  G 403 (-2.9A)
AMP  G 403 (-3.5A)
AMP  G 403 (-2.3A)
None
0.72A 3kpcA-4rerG:
11.2
3kpcA-4rerG:
20.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4u9u NA(+)-TRANSLOCATING
NADH-QUINONE
REDUCTASE SUBUNIT F


(Vibrio cholerae)
PF00175
(NAD_binding_1)
PF00970
(FAD_binding_6)
5 ILE A 279
VAL A 387
ILE A 388
ASN A 400
ILE A 401
None
1.26A 3kpcA-4u9uA:
undetectable
3kpcA-4u9uA:
18.44
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.
4wfs TRNA-DIHYDROURIDINE(
20) SYNTHASE
[NAD(P)+]-LIKE


(Homo sapiens)
PF01207
(Dus)
5 ILE A 203
THR A 165
VAL A 169
ILE A 172
ILE A 156
None
1.14A 3kpcA-4wfsA:
undetectable
3kpcA-4wfsA:
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.
4x9q SUPEROXIDE DISMUTASE
[MN] 2,
MITOCHONDRIAL


(Caenorhabditis
elegans)
PF00081
(Sod_Fe_N)
PF02777
(Sod_Fe_C)
5 ILE A  96
THR A  95
ASP A  99
ILE A 185
PRO A  88
None
1.26A 3kpcA-4x9qA:
undetectable
3kpcA-4x9qA:
19.10
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.
5awe PUTATIVE ACETOIN
UTILIZATION PROTEIN,
ACETOIN
DEHYDROGENASE


(Thermus
thermophilus)
PF00571
(CBS)
5 ILE A 120
THR A 122
ASP A 125
THR A   8
PRO A  36
None
0.66A 3kpcA-5aweA:
12.5
3kpcA-5aweA:
24.38
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.
5awe PUTATIVE ACETOIN
UTILIZATION PROTEIN,
ACETOIN
DEHYDROGENASE


(Thermus
thermophilus)
PF00571
(CBS)
5 THR A  48
ASP A  51
VAL A  85
ILE A 106
PRO A 110
None
0.58A 3kpcA-5aweA:
12.5
3kpcA-5aweA:
24.38
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.
5ccx TRNA
(ADENINE(58)-N(1))-M
ETHYLTRANSFERASE
NON-CATALYTIC
SUBUNIT TRM6


(Homo sapiens)
PF04189
(Gcd10p)
5 ILE B 227
VAL B 205
ILE B 373
ASN B 196
ILE B 197
None
1.09A 3kpcA-5ccxB:
undetectable
3kpcA-5ccxB:
13.90
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.
5e53 CONTACTIN-1

(Gallus gallus)
PF00041
(fn3)
5 ILE A 833
THR A 857
VAL A 818
ILE A 816
ASN A 861
None
1.25A 3kpcA-5e53A:
undetectable
3kpcA-5e53A:
18.67
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.
5ew5 COLICIN-E9

(Escherichia
coli)
PF03515
(Cloacin)
5 THR A 268
VAL A 288
ILE A 156
ASN A 196
ILE A 197
None
1.18A 3kpcA-5ew5A:
undetectable
3kpcA-5ew5A:
13.28
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.
5g49 NUCLEAR
TRANSCRIPTION FACTOR
Y SUBUNIT B-6
NUCLEAR
TRANSCRIPTION FACTOR
Y SUBUNIT C-3


(Arabidopsis
thaliana;
Arabidopsis
thaliana)
PF00808
(CBFD_NFYB_HMF)
PF00808
(CBFD_NFYB_HMF)
5 ILE A  90
THR B 109
ILE A  69
ILE A  82
SER A  83
None
None
None
None
ACT  B1152 (-2.7A)
1.20A 3kpcA-5g49A:
undetectable
3kpcA-5g49A:
24.80
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.
5g5x SITE-2 PROTEASE

(Archaeoglobus
fulgidus)
PF00571
(CBS)
6 ILE A 277
THR A 279
ASP A 282
VAL A 300
ILE A 321
PRO A 325
ATP  A1355 (-4.1A)
ATP  A1355 (-2.4A)
ATP  A1355 (-1.9A)
ATP  A1355 (-3.8A)
ATP  A1355 (-4.5A)
None
0.58A 3kpcA-5g5xA:
17.7
3kpcA-5g5xA:
29.68
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.
5gzp TRIOSEPHOSPHATE
ISOMERASE


(Plasmodium
falciparum)
PF00121
(TIM)
5 ILE A 204
ASP A 227
VAL A 192
ILE A 191
ILE A 188
None
1.19A 3kpcA-5gzpA:
undetectable
3kpcA-5gzpA:
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.
5hd2 PARASPORAL CRYSTAL
PROTEIN


(Bacillus
thuringiensis)
PF03318
(ETX_MTX2)
5 ILE A   3
THR A 103
ASP A   5
ILE A 108
SER A 109
None
1.19A 3kpcA-5hd2A:
undetectable
3kpcA-5hd2A:
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.
5jcf MELANOMA
DIFFERENTIATION
ASSOCIATED PROTEIN-5


(Gallus gallus)
PF00271
(Helicase_C)
PF04851
(ResIII)
PF11648
(RIG-I_C-RD)
5 ILE A 501
THR A 440
ILE A 510
ASN A 317
PRO A 483
None
1.25A 3kpcA-5jcfA:
undetectable
3kpcA-5jcfA:
11.97
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.
5ltm PHENYLALANINE
AMMONIA LYASE


(Anabaena)
no annotation 5 ILE B  77
THR B  81
ILE B 350
ILE B  67
PRO B 348
None
1.27A 3kpcA-5ltmB:
undetectable
3kpcA-5ltmB:
12.71
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.
5tc3 INOSINE-5'-MONOPHOSP
HATE DEHYDROGENASE


(Eremothecium
gossypii)
PF00478
(IMPDH)
PF00571
(CBS)
7 ILE A 163
THR A 165
ASP A 168
THR A 184
VAL A 187
ILE A 188
PRO A 212
ATP  A 601 ( 4.6A)
ATP  A 601 (-2.7A)
ATP  A 601 (-2.3A)
ATP  A 601 (-2.8A)
ATP  A 601 (-4.0A)
ATP  A 601 (-4.2A)
ATP  A 601 ( 4.9A)
0.45A 3kpcA-5tc3A:
14.5
3kpcA-5tc3A:
14.23
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.
5ywz SUN
DOMAIN-CONTAINING
PROTEIN 1


(Mus musculus)
no annotation 5 ILE A 719
VAL A 708
ILE A 707
ASN A 730
ILE A 727
None
1.14A 3kpcA-5ywzA:
undetectable
3kpcA-5ywzA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6caa ELECTROGENIC SODIUM
BICARBONATE
COTRANSPORTER 1


(Homo sapiens)
no annotation 5 ASP A 754
VAL A 802
ILE A 805
ASN A 763
ILE A 761
None
1.26A 3kpcA-6caaA:
undetectable
3kpcA-6caaA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6d6v TELOMERASE
HOLOENZYME TEB2
SUBUNIT


(Tetrahymena
thermophila)
no annotation 5 VAL E  99
ILE E 100
ILE E  85
SER E  78
PRO E  83
None
1.10A 3kpcA-6d6vE:
undetectable
3kpcA-6d6vE:
undetectable