SIMILAR PATTERNS OF AMINO ACIDS FOR 4K8K_B_ADNB403

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.
1d6n PROTEIN
(HYPOXANTHINE-GUANIN
E
PHOSPHORIBOSYLTRANSF
ERASE)


(Homo sapiens)
PF00156
(Pribosyltran)
5 ASP A 134
GLY A  70
GLY A  69
ILE A 135
GLU A 196
PRP  A 312 ( 2.9A)
PRP  A 312 (-3.1A)
PRP  A 312 (-4.3A)
PPO  A 300 ( 4.5A)
None
1.01A 4k8kB-1d6nA:
undetectable
4k8kB-1d6nA:
19.25
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.
1dgm ADENOSINE KINASE

(Toxoplasma
gondii)
PF00294
(PfkB)
7 ASN A  20
ILE A  22
ASP A  24
GLY A  68
GLY A  69
ASN A  73
ASP A 318
ADN  A 375 ( 3.8A)
ADN  A 375 ( 4.3A)
ADN  A 375 (-2.9A)
ADN  A 375 ( 4.5A)
ADN  A 375 (-2.9A)
ADN  A 375 ( 4.9A)
ADN  A 375 ( 3.1A)
0.60A 4k8kB-1dgmA:
36.2
4k8kB-1dgmA:
27.96
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.
1dgm ADENOSINE KINASE

(Toxoplasma
gondii)
PF00294
(PfkB)
7 ILE A  22
ASP A  24
GLY A  68
GLY A  69
ASN A  73
THR A 140
ASP A 318
ADN  A 375 ( 4.3A)
ADN  A 375 (-2.9A)
ADN  A 375 ( 4.5A)
ADN  A 375 (-2.9A)
ADN  A 375 ( 4.9A)
ADN  A 375 ( 4.9A)
ADN  A 375 ( 3.1A)
0.48A 4k8kB-1dgmA:
36.2
4k8kB-1dgmA:
27.96
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.
1hqr STREPTOCOCCAL
PYROGENIC EXOTOXIN C


(Streptococcus
pyogenes)
PF01123
(Stap_Strp_toxin)
PF02876
(Stap_Strp_tox_C)
5 ILE D 586
GLY D 589
GLY D 588
ASN D 691
ILE D 539
None
0.99A 4k8kB-1hqrD:
undetectable
4k8kB-1hqrD:
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.
1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT


(Escherichia
coli)
PF00384
(Molybdopterin)
PF01568
(Molydop_binding)
PF04879
(Molybdop_Fe4S4)
5 ASN A 628
ASP A 456
GLY A 453
ASN A 171
ILE A 738
None
1.03A 4k8kB-1kqfA:
undetectable
4k8kB-1kqfA:
17.29
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.
1rk2 RIBOKINASE

(Escherichia
coli)
PF00294
(PfkB)
6 ASP A  16
GLY A  41
GLY A  42
ASN A  46
ILE A 100
ASP A 255
RIB  A 311 (-2.8A)
RIB  A 311 (-3.3A)
RIB  A 311 (-3.4A)
RIB  A 311 (-3.3A)
None
RIB  A 311 (-3.1A)
0.35A 4k8kB-1rk2A:
35.6
4k8kB-1rk2A:
25.86
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.
1rk2 RIBOKINASE

(Escherichia
coli)
PF00294
(PfkB)
5 GLY A  41
GLY A  42
ASN A  46
GLU A 143
ASP A 255
RIB  A 311 (-3.3A)
RIB  A 311 (-3.4A)
RIB  A 311 (-3.3A)
RIB  A 311 (-2.5A)
RIB  A 311 (-3.1A)
0.82A 4k8kB-1rk2A:
35.6
4k8kB-1rk2A:
25.86
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.
1rk2 RIBOKINASE

(Escherichia
coli)
PF00294
(PfkB)
5 GLY A  41
GLY A  42
ASN A  46
ILE A 110
ASP A 255
RIB  A 311 (-3.3A)
RIB  A 311 (-3.4A)
RIB  A 311 (-3.3A)
RIB  A 311 ( 4.6A)
RIB  A 311 (-3.1A)
0.77A 4k8kB-1rk2A:
35.6
4k8kB-1rk2A:
25.86
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.
1to6 GLYCERATE KINASE

(Neisseria
meningitidis)
PF02595
(Gly_kinase)
5 ASP A 138
GLY A 139
GLY A 246
SER A 136
THR A 134
None
None
None
None
SO4  A 373 (-3.1A)
0.95A 4k8kB-1to6A:
5.7
4k8kB-1to6A:
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.
1ty2 PUTATIVE EXOTOXIN
(SUPERANTIGEN)


(Streptococcus
pyogenes)
PF01123
(Stap_Strp_toxin)
PF02876
(Stap_Strp_tox_C)
5 ILE A  87
GLY A  90
GLY A  89
ASN A 193
ILE A  40
None
0.98A 4k8kB-1ty2A:
undetectable
4k8kB-1ty2A:
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.
1tz6 PUTATIVE SUGAR
KINASE


(Salmonella
enterica)
PF00294
(PfkB)
6 ASP A  16
GLY A  30
GLY A  31
ASN A  35
THR A 248
ASP A 252
AIS  A 402 (-2.5A)
AIS  A 402 ( 4.2A)
AIS  A 402 (-3.8A)
AIS  A 402 (-3.9A)
None
AIS  A 402 (-3.0A)
0.41A 4k8kB-1tz6A:
35.1
4k8kB-1tz6A:
27.75
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.
1ua4 ADP-DEPENDENT
GLUCOKINASE


(Pyrococcus
furiosus)
PF04587
(ADP_PFK_GK)
5 ASP A  34
GLY A 111
GLY A 112
ILE A 178
ASP A 440
GLC  A1457 ( 2.8A)
GLC  A1457 ( 3.5A)
GLC  A1457 ( 3.7A)
None
BGC  A2457 ( 2.7A)
0.40A 4k8kB-1ua4A:
24.6
4k8kB-1ua4A:
21.15
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.
1v19 2-KETO-3-DEOXYGLUCON
ATE KINASE


(Thermus
thermophilus)
PF00294
(PfkB)
5 GLY A  33
GLY A  34
ASN A  38
GLU A  36
ASP A 251
None
0.55A 4k8kB-1v19A:
36.2
4k8kB-1v19A:
25.61
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.
1vko INOSITOL-3-PHOSPHATE
SYNTHASE


(Caenorhabditis
elegans)
PF01658
(Inos-1-P_synth)
PF07994
(NAD_binding_5)
5 ASN A  76
ASP A 148
GLY A  73
GLY A  74
ILE A 149
NAD  A 601 ( 2.9A)
NAD  A 601 (-2.7A)
NAD  A 601 (-4.3A)
NAD  A 601 (-3.3A)
NAD  A 601 (-4.1A)
0.98A 4k8kB-1vkoA:
3.4
4k8kB-1vkoA:
22.53
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.
1vm7 RIBOKINASE

(Thermotoga
maritima)
PF00294
(PfkB)
5 ASP A  14
GLY A  39
GLY A  40
ASN A  44
ASP A 246
None
0.55A 4k8kB-1vm7A:
30.7
4k8kB-1vm7A:
26.61
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.
1vm7 RIBOKINASE

(Thermotoga
maritima)
PF00294
(PfkB)
6 GLY A  39
GLY A  40
ASN A  44
GLU A 137
THR A 242
ASP A 246
None
0.96A 4k8kB-1vm7A:
30.7
4k8kB-1vm7A:
26.61
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.
1wye 2-KETO-3-DEOXYGLUCON
ATE KINASE


(Sulfurisphaera
tokodaii)
PF00294
(PfkB)
5 GLY A  34
ASN A  38
GLU A  36
THR A 252
ASP A 256
None
0.92A 4k8kB-1wyeA:
37.2
4k8kB-1wyeA:
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.
1zmr PHOSPHOGLYCERATE
KINASE


(Escherichia
coli)
PF00162
(PGK)
5 ILE A 217
GLY A 215
GLY A 191
ILE A 188
ASP A 342
None
1.03A 4k8kB-1zmrA:
3.0
4k8kB-1zmrA:
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.
2abq FRUCTOSE 1-PHOSPHATE
KINASE


(Bacillus
halodurans)
PF00294
(PfkB)
5 ASN A   8
ASP A  12
GLY A  36
GLY A  37
ASN A  41
None
1.02A 4k8kB-2abqA:
27.0
4k8kB-2abqA:
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.
2abq FRUCTOSE 1-PHOSPHATE
KINASE


(Bacillus
halodurans)
PF00294
(PfkB)
5 ASP A  12
GLY A  36
GLY A  37
ASN A  41
ASP A 249
None
0.38A 4k8kB-2abqA:
27.0
4k8kB-2abqA:
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.
2afb 2-KETO-3-DEOXYGLUCON
ATE KINASE


(Thermotoga
maritima)
PF00294
(PfkB)
5 GLY A  32
GLY A  33
ASN A  37
GLU A  35
ASP A 280
None
0.69A 4k8kB-2afbA:
33.1
4k8kB-2afbA:
27.44
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.
2ajr SUGAR KINASE, PFKB
FAMILY


(Thermotoga
maritima)
PF00294
(PfkB)
6 ASN A   8
ASP A  12
GLY A  39
GLY A  40
ASN A  44
ASP A 261
None
ACT  A 321 (-3.1A)
ACT  A 321 ( 4.3A)
ACT  A 321 (-3.9A)
ACT  A 321 (-3.9A)
None
0.89A 4k8kB-2ajrA:
25.8
4k8kB-2ajrA:
24.53
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.
2c49 SUGAR KINASE MJ0406

(Methanocaldococcus
jannaschii)
PF00294
(PfkB)
5 ASP A  17
ASN A  47
ILE A  19
THR A 111
ASP A 247
ADN  A1301 (-2.8A)
ADN  A1301 (-3.4A)
None
ADN  A1301 (-3.1A)
ADN  A1301 (-2.9A)
1.02A 4k8kB-2c49A:
33.3
4k8kB-2c49A:
25.48
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.
2c49 SUGAR KINASE MJ0406

(Methanocaldococcus
jannaschii)
PF00294
(PfkB)
7 ASP A  17
GLY A  42
GLY A  43
ASN A  47
ILE A  19
THR A 243
ASP A 247
ADN  A1301 (-2.8A)
ADN  A1301 (-3.4A)
ADN  A1301 (-3.3A)
ADN  A1301 (-3.4A)
None
ANP  A1304 (-4.3A)
ADN  A1301 (-2.9A)
1.11A 4k8kB-2c49A:
33.3
4k8kB-2c49A:
25.48
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.
2c49 SUGAR KINASE MJ0406

(Methanocaldococcus
jannaschii)
PF00294
(PfkB)
7 ASP A  17
GLY A  42
GLY A  43
ASN A  47
ILE A 101
THR A 243
ASP A 247
ADN  A1301 (-2.8A)
ADN  A1301 (-3.4A)
ADN  A1301 (-3.3A)
ADN  A1301 (-3.4A)
None
ANP  A1304 (-4.3A)
ADN  A1301 (-2.9A)
0.41A 4k8kB-2c49A:
33.3
4k8kB-2c49A:
25.48
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.
2cff 1-(5-PHOSPHORIBOSYL)
-5-[(5-PHOSPHORIBOSY
LAMINO)
METHYLIDENEAMINO]
IMIDAZOLE-4-CARBOXAM
IDE ISOMERASE


(Thermotoga
maritima)
PF00977
(His_biosynth)
5 ILE A 197
GLY A 195
GLY A 196
GLU A 174
THR A 180
None
1.05A 4k8kB-2cffA:
undetectable
4k8kB-2cffA:
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.
2f02 TAGATOSE-6-PHOSPHATE
KINASE


(Enterococcus
faecalis)
PF00294
(PfkB)
6 ASN A   8
ASP A  12
GLY A  36
GLY A  37
ASN A  41
ASP A 255
None
None
None
None
None
ATP  A 411 (-4.1A)
1.15A 4k8kB-2f02A:
26.5
4k8kB-2f02A:
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.
2f02 TAGATOSE-6-PHOSPHATE
KINASE


(Enterococcus
faecalis)
PF00294
(PfkB)
6 ASP A  12
GLY A  36
GLY A  37
ASN A  41
SER A  90
ASP A 255
None
None
None
None
None
ATP  A 411 (-4.1A)
1.00A 4k8kB-2f02A:
26.5
4k8kB-2f02A:
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.
2f02 TAGATOSE-6-PHOSPHATE
KINASE


(Enterococcus
faecalis)
PF00294
(PfkB)
5 ASP A  12
GLY A  36
GLY A  37
THR A 291
ASP A 255
None
None
None
None
ATP  A 411 (-4.1A)
1.00A 4k8kB-2f02A:
26.5
4k8kB-2f02A:
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.
2f5v PYRANOSE 2-OXIDASE

(Peniophora sp.
SG)
PF05199
(GMC_oxred_C)
5 ILE A  57
GLY A 581
GLY A 582
ASN A 585
THR A  60
FAD  A1625 (-4.0A)
None
FAD  A1625 ( 3.9A)
None
None
1.00A 4k8kB-2f5vA:
2.8
4k8kB-2f5vA:
22.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2hk0 D-PSICOSE
3-EPIMERASE


(Agrobacterium
tumefaciens)
PF01261
(AP_endonuc_2)
5 ILE A  66
GLY A 105
GLY A  65
ILE A 145
THR A  92
ILE  A  66 ( 0.7A)
GLY  A 105 ( 0.0A)
GLY  A  65 ( 0.0A)
ILE  A 145 ( 0.7A)
THR  A  92 ( 0.8A)
0.98A 4k8kB-2hk0A:
undetectable
4k8kB-2hk0A:
24.66
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.
2i6b ADENOSINE KINASE

(Homo sapiens)
PF00294
(PfkB)
6 ASN A  14
ASP A  18
GLY A  63
GLY A  64
ASN A  68
ASP A 300
89I  A 500 (-4.0A)
None
None
89I  A 500 (-3.5A)
None
None
0.55A 4k8kB-2i6bA:
33.1
4k8kB-2i6bA:
28.90
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.
2jg5 FRUCTOSE 1-PHOSPHATE
KINASE


(Staphylococcus
aureus)
PF00294
(PfkB)
5 ASP A  12
GLY A  36
GLY A  37
ASN A  41
ASP A 249
None
0.65A 4k8kB-2jg5A:
26.3
4k8kB-2jg5A:
21.90
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.
2nwh CARBOHYDRATE KINASE

(Agrobacterium
fabrum)
PF00294
(PfkB)
5 ASP A  13
GLY A  37
GLY A  38
ASN A  42
ASP A 253
None
None
CL  A 403 (-3.5A)
None
None
0.90A 4k8kB-2nwhA:
26.6
4k8kB-2nwhA:
26.17
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.
2p18 GLYOXALASE II

(Leishmania
infantum)
PF00753
(Lactamase_B)
PF16123
(HAGH_C)
5 ILE A 192
ILE A 206
THR A 204
GLU A 132
THR A 162
None
1.00A 4k8kB-2p18A:
undetectable
4k8kB-2p18A:
23.78
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.
2qcv PUTATIVE
5-DEHYDRO-2-DEOXYGLU
CONOKINASE


(Bacillus
halodurans)
PF00294
(PfkB)
5 ASP A  22
GLY A  43
GLY A  44
ASN A  48
ASP A 272
None
None
None
None
PGE  A 332 (-3.6A)
0.37A 4k8kB-2qcvA:
35.7
4k8kB-2qcvA:
25.14
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.
2qcv PUTATIVE
5-DEHYDRO-2-DEOXYGLU
CONOKINASE


(Bacillus
halodurans)
PF00294
(PfkB)
5 GLY A  43
GLY A  44
ASN A  48
ILE A 113
ASP A 272
None
None
None
None
PGE  A 332 (-3.6A)
0.62A 4k8kB-2qcvA:
35.7
4k8kB-2qcvA:
25.14
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.
2rbc SUGAR KINASE

(Agrobacterium
fabrum)
PF00294
(PfkB)
5 ASP A  19
GLY A  45
SER A 101
ILE A 103
ASP A 254
GOL  A 333 (-2.9A)
GOL  A 333 ( 4.1A)
GOL  A 333 ( 2.2A)
None
None
0.97A 4k8kB-2rbcA:
32.0
4k8kB-2rbcA:
28.13
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.
2v7y CHAPERONE PROTEIN
DNAK


(Geobacillus
kaustophilus)
PF00012
(HSP70)
5 ASN A 194
GLY A 170
GLY A 171
SER A  66
ASP A 200
None
ADP  A1505 (-3.5A)
None
None
None
1.02A 4k8kB-2v7yA:
undetectable
4k8kB-2v7yA:
22.16
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.
2var FRUCTOKINASE

(Sulfolobus
solfataricus)
PF00294
(PfkB)
5 GLY A  34
ASN A  38
GLU A  36
THR A 254
ASP A 258
KDG  A1313 ( 3.3A)
KDF  A1314 ( 4.2A)
None
ANP  A1315 ( 4.6A)
KDF  A1314 (-2.8A)
0.71A 4k8kB-2varA:
36.9
4k8kB-2varA:
25.26
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.
2y7c GENE 0.3 PROTEIN
TYPE I RESTRICTION
ENZYME ECOKI M
PROTEIN


(Escherichia
coli;
Escherichia
virus T7)
PF02384
(N6_Mtase)
PF08684
(ocr)
PF12161
(HsdM_N)
5 GLY B 318
GLY B 319
ASN D  39
ILE B 324
THR B 285
None
1.06A 4k8kB-2y7cB:
3.2
4k8kB-2y7cB:
19.85
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.
3b1r RIBOKINASE, PUTATIVE

(Burkholderia
thailandensis)
PF00294
(PfkB)
5 ASP A  12
GLY A  47
ASN A  52
ILE A  14
THR A 115
AMP  A 501 (-2.9A)
AMP  A 501 ( 3.7A)
AMP  A 501 (-3.3A)
None
AMP  A 501 ( 4.2A)
0.98A 4k8kB-3b1rA:
31.5
4k8kB-3b1rA:
26.63
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.
3b1r RIBOKINASE, PUTATIVE

(Burkholderia
thailandensis)
PF00294
(PfkB)
6 ASP A  12
GLY A  47
GLY A  48
ASN A  52
ILE A  14
THR A 249
AMP  A 501 (-2.9A)
AMP  A 501 ( 3.7A)
AMP  A 501 (-3.3A)
AMP  A 501 (-3.3A)
None
None
1.07A 4k8kB-3b1rA:
31.5
4k8kB-3b1rA:
26.63
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.
3b1r RIBOKINASE, PUTATIVE

(Burkholderia
thailandensis)
PF00294
(PfkB)
7 ASP A  12
GLY A  47
GLY A  48
ASN A  52
ILE A 105
THR A 249
ASP A 253
AMP  A 501 (-2.9A)
AMP  A 501 ( 3.7A)
AMP  A 501 (-3.3A)
AMP  A 501 (-3.3A)
None
None
AMP  A 501 (-2.8A)
0.57A 4k8kB-3b1rA:
31.5
4k8kB-3b1rA:
26.63
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.
3b3l KETOHEXOKINASE

(Homo sapiens)
PF00294
(PfkB)
5 GLY A  40
GLY A  41
ASN A  45
GLU A 139
ASP A 258
None
0.43A 4k8kB-3b3lA:
27.8
4k8kB-3b3lA:
24.30
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.
3czm L-LACTATE
DEHYDROGENASE


(Toxoplasma
gondii)
PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C)
5 ASP A 143
GLY A 288
GLY A 193
ASN A 165
ASP A 168
None
0.97A 4k8kB-3czmA:
6.2
4k8kB-3czmA:
23.82
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.
3ewm UNCHARACTERIZED
SUGAR KINASE PH1459


(Pyrococcus
horikoshii)
PF00294
(PfkB)
5 ASP A  13
GLY A  33
GLY A  34
ASN A  38
ASP A 247
None
0.35A 4k8kB-3ewmA:
33.4
4k8kB-3ewmA:
25.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ewm UNCHARACTERIZED
SUGAR KINASE PH1459


(Pyrococcus
horikoshii)
PF00294
(PfkB)
5 GLY A  33
GLY A  34
ASN A  38
THR A 243
ASP A 247
None
0.73A 4k8kB-3ewmA:
33.4
4k8kB-3ewmA:
25.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3go7 RIBOKINASE RBSK

(Mycobacterium
tuberculosis)
PF00294
(PfkB)
6 ASP A  25
GLY A  50
GLY A  51
ASN A  55
ILE A 108
ASP A 242
RIB  A 305 (-2.8A)
RIB  A 305 ( 3.7A)
RIB  A 305 (-3.1A)
RIB  A 305 (-3.2A)
None
RIB  A 305 (-2.9A)
0.46A 4k8kB-3go7A:
31.7
4k8kB-3go7A:
26.95
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.
3hj6 FRUCTOKINASE

(Halothermothrix
orenii)
PF00294
(PfkB)
5 ASP A  33
GLY A  54
GLY A  55
ASN A  59
ASP A 275
None
0.40A 4k8kB-3hj6A:
28.9
4k8kB-3hj6A:
27.75
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.
3i16 ALUMINUM RESISTANCE
PROTEIN


(Clostridium
novyi)
PF06838
(Met_gamma_lyase)
5 ILE A 388
GLY A 246
GLY A 247
SER A 386
ILE A 383
None
1.06A 4k8kB-3i16A:
undetectable
4k8kB-3i16A:
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.
3i3y CARBOHYDRATE KINASE

(Klebsiella
pneumoniae)
PF00294
(PfkB)
6 ASN A 138
GLY A  37
GLY A  38
ASN A  42
THR A 228
ASP A 232
None
1.14A 4k8kB-3i3yA:
27.1
4k8kB-3i3yA:
24.53
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.
3i3y CARBOHYDRATE KINASE

(Klebsiella
pneumoniae)
PF00294
(PfkB)
6 ASP A  12
GLY A  37
GLY A  38
ASN A  42
THR A 107
THR A 228
None
0.77A 4k8kB-3i3yA:
27.1
4k8kB-3i3yA:
24.53
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.
3i3y CARBOHYDRATE KINASE

(Klebsiella
pneumoniae)
PF00294
(PfkB)
6 ASP A  12
GLY A  37
GLY A  38
ASN A  42
THR A 228
ASP A 232
None
0.75A 4k8kB-3i3yA:
27.1
4k8kB-3i3yA:
24.53
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.
3in1 UNCHARACTERIZED
SUGAR KINASE YDJH


(Escherichia
coli)
PF00294
(PfkB)
6 ILE A  13
ASP A  15
GLY A  41
GLY A  42
ASN A  46
ASP A 260
None
0.80A 4k8kB-3in1A:
32.2
4k8kB-3in1A:
27.64
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.
3kd6 CARBOHYDRATE KINASE,
PFKB FAMILY


(Chlorobaculum
tepidum)
PF00294
(PfkB)
5 ASP A  12
GLY A  26
GLY A  27
THR A 233
ASP A 237
AMP  A 509 (-2.8A)
AMP  A 509 ( 3.8A)
AMP  A 509 (-3.4A)
AMP  A 509 ( 4.8A)
AMP  A 509 ( 3.3A)
0.97A 4k8kB-3kd6A:
29.4
4k8kB-3kd6A:
22.91
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.
3kzh PROBABLE SUGAR
KINASE


(Clostridium
perfringens)
PF00294
(PfkB)
5 GLY A  42
GLY A  43
ASN A  47
THR A 253
ASP A 257
None
0.54A 4k8kB-3kzhA:
28.8
4k8kB-3kzhA:
24.87
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.
3lhx KETODEOXYGLUCONOKINA
SE


(Shigella
flexneri)
PF00294
(PfkB)
5 GLY A 100
GLY A 101
ASN A 105
THR A 333
ASP A 337
None
0.52A 4k8kB-3lhxA:
30.5
4k8kB-3lhxA:
24.34
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.
3lki FRUCTOKINASE

(Xylella
fastidiosa)
PF00294
(PfkB)
5 ASN A 146
ASP A  24
GLY A  44
GLY A  45
ASN A  49
None
0.93A 4k8kB-3lkiA:
25.7
4k8kB-3lkiA:
25.13
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3loo ANOPHELES GAMBIAE
ADENOSINE KINASE


(Anopheles
gambiae)
PF00294
(PfkB)
6 ASN A  14
ASP A  18
GLY A  63
GLY A  64
ASN A  68
ASP A 300
B4P  A 349 ( 4.0A)
B4P  A 349 (-2.8A)
B4P  A 349 ( 3.8A)
B4P  A 349 (-3.5A)
B4P  A 349 (-3.6A)
B4P  A 349 (-3.4A)
0.27A 4k8kB-3looA:
39.4
4k8kB-3looA:
30.91
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.
3n54 SPORE GERMINATION
PROTEIN B3


(Bacillus
subtilis)
PF05504
(Spore_GerAC)
5 ILE B 253
GLY B 237
GLY B 238
SER B 256
THR B 277
None
1.01A 4k8kB-3n54B:
undetectable
4k8kB-3n54B:
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.
3of7 REGULATOR OF
CHROMOSOME
CONDENSATION


(Saccharomyces
cerevisiae)
PF00415
(RCC1)
PF13540
(RCC1_2)
5 ASN A 450
ILE A 452
GLY A 464
GLY A 465
SER A  42
None
0.94A 4k8kB-3of7A:
undetectable
4k8kB-3of7A:
23.53
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.
3otx ADENOSINE KINASE,
PUTATIVE


(Trypanosoma
brucei)
PF00294
(PfkB)
6 ASN A  13
ASP A  17
GLY A  62
GLY A  63
ASN A  67
ASP A 299
AP5  A 346 (-4.1A)
AP5  A 346 (-2.8A)
AP5  A 346 (-3.6A)
AP5  A 346 (-3.5A)
AP5  A 346 (-3.4A)
AP5  A 346 ( 3.2A)
0.27A 4k8kB-3otxA:
39.5
4k8kB-3otxA:
25.63
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.
3pl2 SUGAR KINASE,
RIBOKINASE FAMILY


(Corynebacterium
glutamicum)
PF00294
(PfkB)
5 ASP A  19
GLY A  40
GLY A  41
ASN A  45
ASP A 264
None
0.30A 4k8kB-3pl2A:
35.1
4k8kB-3pl2A:
24.12
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.
3q1y LIN2199 PROTEIN

(Listeria
innocua)
PF00294
(PfkB)
5 ASN A   8
ASP A  12
GLY A  37
GLY A  38
ASP A 251
None
1.01A 4k8kB-3q1yA:
27.3
4k8kB-3q1yA:
25.85
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.
3ry7 RIBOKINASE

(Staphylococcus
aureus)
PF00294
(PfkB)
5 ASP A  14
GLY A  40
GLY A  41
ASN A  45
ASP A 254
GOL  A 401 (-3.1A)
GOL  A 401 ( 3.7A)
GOL  A 401 (-3.8A)
GOL  A 401 (-3.9A)
None
0.52A 4k8kB-3ry7A:
28.2
4k8kB-3ry7A:
25.73
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.
3ry7 RIBOKINASE

(Staphylococcus
aureus)
PF00294
(PfkB)
5 ASP A  14
GLY A  40
GLY A  41
ASN A  45
ILE A  99
GOL  A 401 (-3.1A)
GOL  A 401 ( 3.7A)
GOL  A 401 (-3.8A)
GOL  A 401 (-3.9A)
None
0.64A 4k8kB-3ry7A:
28.2
4k8kB-3ry7A:
25.73
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.
3ry7 RIBOKINASE

(Staphylococcus
aureus)
PF00294
(PfkB)
5 GLY A  40
GLY A  41
ASN A  45
GLU A 142
ASP A 254
GOL  A 401 ( 3.7A)
GOL  A 401 (-3.8A)
GOL  A 401 (-3.9A)
GOL  A 401 (-2.8A)
None
1.00A 4k8kB-3ry7A:
28.2
4k8kB-3ry7A:
25.73
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.
3s4d LACTOSE
PHOSPHORYLASE


(Cellulomonas
uda)
PF06165
(Glyco_transf_36)
PF17167
(Glyco_hydro_36)
5 GLY A  42
GLY A  69
SER A  84
ILE A 106
THR A  82
None
0.93A 4k8kB-3s4dA:
undetectable
4k8kB-3s4dA:
18.01
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ubo ADENOSINE KINASE

(Sinorhizobium
meliloti)
PF00294
(PfkB)
12 ASN A  11
ILE A  13
ASP A  15
GLY A  58
GLY A  59
ASN A  63
SER A 115
ILE A 117
THR A 129
GLU A 156
THR A 274
ASP A 278
ADN  A 353 (-3.7A)
ADN  A 353 (-3.7A)
ADN  A 353 (-2.8A)
ADN  A 353 (-3.3A)
ADN  A 353 (-3.2A)
ADN  A 353 (-3.4A)
ADN  A 353 ( 4.0A)
None
ADN  A 353 (-3.3A)
ADN  A 353 (-3.2A)
ADN  A 353 ( 4.8A)
ADN  A 353 (-3.3A)
0.21A 4k8kB-3uboA:
56.9
4k8kB-3uboA:
71.88
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.
3vas PUTATIVE ADENOSINE
KINASE


(Schistosoma
mansoni)
PF00294
(PfkB)
7 ASN A  14
ASP A  18
GLY A  63
GLY A  64
ASN A  68
THR A 136
ASP A 302
ADN  A 401 ( 4.0A)
ADN  A 401 (-2.7A)
ADN  A 401 ( 3.8A)
ADN  A 401 (-3.7A)
ADN  A 401 (-3.7A)
ADN  A 401 (-3.1A)
ADN  A 401 (-2.9A)
0.37A 4k8kB-3vasA:
40.5
4k8kB-3vasA:
28.75
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.
3zyv AOX3

(Mus musculus)
PF00111
(Fer2)
PF00941
(FAD_binding_5)
PF01315
(Ald_Xan_dh_C)
PF01799
(Fer2_2)
PF02738
(Ald_Xan_dh_C2)
PF03450
(CO_deh_flav_C)
5 ILE A 590
GLY A 589
ILE A 109
GLU A 596
THR A 121
None
0.88A 4k8kB-3zyvA:
undetectable
4k8kB-3zyvA:
14.01
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.
4b8s ADP-DEPENDENT
GLUCOKINASE


(Thermococcus
litoralis)
PF04587
(ADP_PFK_GK)
5 ASP A  42
GLY A 119
GLY A 120
ILE A 186
ASP A 451
GLC  A 468 (-2.7A)
GLC  A 468 (-3.5A)
GLC  A 468 (-3.6A)
None
GLC  A 468 (-2.9A)
0.45A 4k8kB-4b8sA:
23.6
4k8kB-4b8sA:
23.17
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4e3a SUGAR KINASE PROTEIN

(Rhizobium etli)
PF00294
(PfkB)
12 ASN A   9
ILE A  11
ASP A  13
GLY A  56
GLY A  57
ASN A  61
SER A 113
ILE A 115
THR A 127
GLU A 154
THR A 272
ASP A 276
ADN  A 500 (-3.8A)
ADN  A 500 (-3.6A)
ADN  A 500 (-2.7A)
ADN  A 500 (-3.5A)
ADN  A 500 (-3.7A)
ADN  A 500 (-3.5A)
ADN  A 500 ( 3.8A)
None
ADN  A 500 (-3.0A)
ADN  A 500 (-3.0A)
ADN  A 500 (-4.6A)
ADN  A 500 (-2.8A)
0.14A 4k8kB-4e3aA:
62.5
4k8kB-4e3aA:
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.
4fu0 D-ALANINE--D-ALANINE
LIGASE 7


(Enterococcus
faecalis)
PF01820
(Dala_Dala_lig_N)
PF07478
(Dala_Dala_lig_C)
5 ASN A 314
ASP A 243
GLY A 228
ILE A 265
GLU A 312
SO4  A 402 (-3.9A)
None
None
None
ADP  A 401 (-3.3A)
0.93A 4k8kB-4fu0A:
2.6
4k8kB-4fu0A:
22.44
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.
4gm6 PFKB FAMILY
CARBOHYDRATE KINASE


(Listeria grayi)
PF00294
(PfkB)
5 GLY A  33
GLY A  34
ASN A  38
GLU A  36
ASP A 270
GOL  A 401 ( 4.1A)
GOL  A 401 (-3.7A)
GOL  A 401 (-4.4A)
None
GOL  A 401 (-3.0A)
0.62A 4k8kB-4gm6A:
31.2
4k8kB-4gm6A:
28.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4hq1 PROBABLE RECEPTOR
PROTEIN KINASE TMK1


(Arabidopsis
thaliana)
PF00560
(LRR_1)
PF08263
(LRRNT_2)
PF13855
(LRR_8)
5 ILE A 443
GLY A 424
GLY A 444
ILE A 402
THR A 437
None
1.04A 4k8kB-4hq1A:
undetectable
4k8kB-4hq1A:
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.
4j0w U3 SMALL NUCLEOLAR
RNA-INTERACTING
PROTEIN 2


(Homo sapiens)
PF00400
(WD40)
5 ASN A 457
ILE A 149
GLY A 439
SER A 163
ILE A 161
None
0.95A 4k8kB-4j0wA:
undetectable
4k8kB-4j0wA:
21.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4lgn CELLULOSE-BINDING,
FAMILY II


(Acidothermus
cellulolyticus)
no annotation 5 ILE A 467
GLY A 454
GLY A 453
ILE A  14
THR A 431
None
0.93A 4k8kB-4lgnA:
undetectable
4k8kB-4lgnA:
19.65
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.
4pvv ADENOSINE KINASE

(Mycobacterium
tuberculosis)
PF00294
(PfkB)
6 ASP A  12
GLY A  47
GLY A  48
ASN A  52
THR A 253
ASP A 257
HO4  A 401 (-2.4A)
HO4  A 401 (-3.5A)
HO4  A 401 (-3.5A)
HO4  A 401 (-3.8A)
HO4  A 401 (-4.4A)
HO4  A 401 (-3.3A)
0.45A 4k8kB-4pvvA:
29.6
4k8kB-4pvvA:
26.05
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.
4urp FATTY ACID
REPRESSION MUTANT
PROTEIN 2


(Saccharomyces
cerevisiae)
PF00881
(Nitroreductase)
5 ILE A 130
GLY A 126
ILE A  40
THR A 134
THR A  44
None
1.05A 4k8kB-4urpA:
undetectable
4k8kB-4urpA:
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.
4wj3 ASPARTATE--TRNA(ASP/
ASN) LIGASE


(Pseudomonas
aeruginosa)
PF00152
(tRNA-synt_2)
PF01336
(tRNA_anti-codon)
PF02938
(GAD)
5 GLY M 487
GLY M 486
ILE M 237
GLU M 483
THR M 251
None
1.02A 4k8kB-4wj3M:
undetectable
4k8kB-4wj3M:
21.31
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.
4wjm RIBOKINASE:CARBOHYDR
ATE KINASE, PFKB


(Brucella
abortus)
PF00294
(PfkB)
5 ASP A  11
GLY A  29
GLY A  30
ASN A  34
ASP A 249
None
None
None
None
ANP  A 401 ( 4.3A)
0.50A 4k8kB-4wjmA:
31.5
4k8kB-4wjmA:
23.99
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.
4x0e PROBABLE
NICOTINATE-NUCLEOTID
E
ADENYLYLTRANSFERASE


(Mycobacterium
tuberculosis)
PF01467
(CTP_transf_like)
5 GLY A  10
GLY A  11
ILE A 114
THR A  86
ASP A  77
None
0.93A 4k8kB-4x0eA:
undetectable
4k8kB-4x0eA:
22.47
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.
4x2d FIC FAMILY PROTEIN
PUTATIVE
FILAMENTATION
INDUCED BY CAMP
PROTEIN


(Clostridioides
difficile)
PF02661
(Fic)
5 ASN A 169
ILE A 172
GLY A 173
ILE A  83
GLU A 160
None
None
None
None
ATP  A 302 (-3.6A)
0.95A 4k8kB-4x2dA:
undetectable
4k8kB-4x2dA:
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.
4x8f RIBOKINASE

(Vibrio cholerae)
PF00294
(PfkB)
6 ASP A  13
GLY A  38
GLY A  39
ASN A  43
THR A 248
ASP A 252
None
0.69A 4k8kB-4x8fA:
30.2
4k8kB-4x8fA:
27.01
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.
4xf7 CARBOHYDRATE/PYRIMID
INE KINASE, PFKB
FAMILY


(Thermococcus
kodakarensis)
no annotation 5 ASP A  12
GLY A  25
GLY A  26
THR A 215
ASP A 219
INS  A 301 (-2.8A)
INS  A 301 (-3.1A)
INS  A 301 (-3.1A)
INS  A 301 (-4.7A)
INS  A 301 (-2.7A)
0.80A 4k8kB-4xf7A:
24.5
4k8kB-4xf7A:
23.56
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.
4ybr NICOTINATE-NUCLEOTID
E
ADENYLYLTRANSFERASE


(Mycobacterium
tuberculosis)
PF01467
(CTP_transf_like)
5 GLY A  10
GLY A  11
ILE A 114
THR A  86
ASP A  77
NAP  A 301 (-3.1A)
NAP  A 301 (-3.4A)
NAP  A 301 (-3.9A)
NAP  A 301 (-4.0A)
None
1.01A 4k8kB-4ybrA:
2.2
4k8kB-4ybrA:
20.17
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.
5c41 RIBOKINASE

(Homo sapiens)
PF00294
(PfkB)
7 ASP A  27
GLY A  52
GLY A  53
ASN A  57
GLU A 154
THR A 265
ASP A 269
None
None
None
None
None
None
NA  A 403 ( 4.7A)
1.13A 4k8kB-5c41A:
33.3
4k8kB-5c41A:
25.82
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.
5c41 RIBOKINASE

(Homo sapiens)
PF00294
(PfkB)
6 ASP A  27
GLY A  52
GLY A  53
ASN A  57
ILE A 111
GLU A 154
None
1.20A 4k8kB-5c41A:
33.3
4k8kB-5c41A:
25.82
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.
5e4y HOMOSERINE
O-ACETYLTRANSFERASE


(Pseudomonas
veronii)
PF00561
(Abhydrolase_1)
5 ASN A 252
GLY A  90
ASN A  97
ILE A  87
THR A 256
None
1.03A 4k8kB-5e4yA:
undetectable
4k8kB-5e4yA:
24.87
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.
5ey7 FRUCTOKINASE

(Vibrio cholerae)
PF00294
(PfkB)
6 ASP A  30
GLY A  44
GLY A  45
ASN A  49
THR A 262
ASP A 266
None
None
None
None
NA  A 401 (-4.9A)
None
0.52A 4k8kB-5ey7A:
34.6
4k8kB-5ey7A:
27.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5fok IRON TRANSPORT OUTER
MEMBRANE RECEPTOR


(Pseudomonas
aeruginosa)
PF00593
(TonB_dep_Rec)
PF07715
(Plug)
5 ILE A  78
GLY A  77
ASN A 625
GLU A 581
THR A 645
None
1.04A 4k8kB-5fokA:
undetectable
4k8kB-5fokA:
18.58
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.
5ix1 MORC FAMILY CW-TYPE
ZINC FINGER PROTEIN
3


(Mus musculus)
PF07496
(zf-CW)
PF13589
(HATPase_c_3)
5 ASN A 121
ASP A  67
GLY A  69
THR A 119
ASP A  44
None
ANP  A 502 (-3.6A)
None
None
ANP  A 502 (-4.0A)
1.01A 4k8kB-5ix1A:
undetectable
4k8kB-5ix1A:
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.
5o0j ADP-DEPENDENT
GLUCOKINASE


(Pyrococcus
horikoshii)
no annotation 5 ASP A  37
GLY A 114
GLY A 115
ILE A 181
ASP A 443
GLC  A 503 (-2.7A)
GLC  A 503 (-3.5A)
GLC  A 503 (-3.7A)
None
GLC  A 503 (-2.6A)
0.47A 4k8kB-5o0jA:
24.5
4k8kB-5o0jA:
11.90
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.
5obw CHAPERONE PROTEIN
DNAK


(Mycoplasma
genitalium)
no annotation 5 ASN A 204
GLY A 180
GLY A 181
SER A  70
ASP A 210
GOL  A 410 ( 3.9A)
ADP  A 402 (-3.5A)
None
None
None
0.96A 4k8kB-5obwA:
undetectable
4k8kB-5obwA:
10.60
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.
5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE


(Methanocaldococcus
jannaschii)
no annotation 5 ASP A  28
GLY A 106
GLY A 107
ILE A 174
ASP A 442
GLC  A 501 (-2.7A)
GLC  A 501 (-3.2A)
GLC  A 501 (-3.7A)
None
GLC  A 501 ( 2.6A)
0.49A 4k8kB-5od2A:
22.8
4k8kB-5od2A:
13.61
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.
6cw5 RIBOKINASE

(Cryptococcus
neoformans)
no annotation 7 ASP A  16
GLY A  41
GLY A  42
ASN A  46
ILE A  98
THR A 269
ASP A 273
GOL  A 400 (-2.8A)
GOL  A 400 (-3.5A)
GOL  A 400 (-3.3A)
GOL  A 400 (-3.3A)
None
GOL  A 400 ( 4.9A)
None
0.43A 4k8kB-6cw5A:
30.4
4k8kB-6cw5A:
13.79
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.
6cw5 RIBOKINASE

(Cryptococcus
neoformans)
no annotation 5 GLY A  41
GLY A  42
ASN A  46
GLU A 138
ASP A 273
GOL  A 400 (-3.5A)
GOL  A 400 (-3.3A)
GOL  A 400 (-3.3A)
GOL  A 400 (-2.8A)
None
0.89A 4k8kB-6cw5A:
30.4
4k8kB-6cw5A:
13.79
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.
6cw5 RIBOKINASE

(Cryptococcus
neoformans)
no annotation 5 GLY A  41
GLY A  42
ASN A  46
ILE A 108
ASP A 273
GOL  A 400 (-3.5A)
GOL  A 400 (-3.3A)
GOL  A 400 (-3.3A)
GOL  A 400 ( 4.8A)
None
0.85A 4k8kB-6cw5A:
30.4
4k8kB-6cw5A:
13.79
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.
1h7k CATALASE

(Proteus
mirabilis)
PF00199
(Catalase)
PF06628
(Catalase-rel)
4 SER A 336
LEU A 330
TYR A 337
PRO A 141
HEM  A 600 (-3.5A)
None
HEM  A 600 (-3.8A)
None
1.50A 4k8kB-1h7kA:
0.0
4k8kB-1h7kA:
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.
1hn0 CHONDROITIN ABC
LYASE I


(Proteus
vulgaris)
PF02278
(Lyase_8)
PF02884
(Lyase_8_C)
PF09092
(Lyase_N)
PF09093
(Lyase_catalyt)
4 SER A 440
LEU A 519
TYR A 476
PRO A 485
None
1.47A 4k8kB-1hn0A:
0.0
4k8kB-1hn0A:
14.63
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.
1sy7 CATALASE 1

(Neurospora
crassa)
PF00199
(Catalase)
PF01965
(DJ-1_PfpI)
PF06628
(Catalase-rel)
4 SER A 378
LEU A 372
TYR A 379
PRO A 179
HDD  A1880 ( 2.7A)
None
HDD  A1880 ( 4.0A)
None
1.49A 4k8kB-1sy7A:
3.8
4k8kB-1sy7A:
18.79
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.
1vcz RNASE NGR3

(Nicotiana
glutinosa)
PF00445
(Ribonuclease_T2)
4 SER A 101
LEU A  60
TYR A 108
PRO A  51
None
1.42A 4k8kB-1vczA:
undetectable
4k8kB-1vczA:
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.
1z1d LARGE T ANTIGEN

(Macaca mulatta
polyomavirus 1)
PF02217
(T_Ag_DNA_bind)
4 SER B  61
LEU B  18
TYR B  34
PRO B 112
None
1.42A 4k8kB-1z1dB:
0.0
4k8kB-1z1dB:
15.86
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.
2xf2 CATALASE

(Penicillium
janthinellum)
PF00199
(Catalase)
PF06628
(Catalase-rel)
4 SER A 350
LEU A 344
TYR A 351
PRO A 151
HDD  A 690 (-2.8A)
None
HDD  A 690 (-3.7A)
None
1.45A 4k8kB-2xf2A:
4.6
4k8kB-2xf2A:
20.77
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ubo ADENOSINE KINASE

(Sinorhizobium
meliloti)
PF00294
(PfkB)
4 SER A  60
LEU A  37
TYR A 158
PRO A 314
ADN  A 353 (-4.6A)
None
ADN  A 353 (-3.6A)
ADN  A 353 (-4.2A)
1.22A 4k8kB-3uboA:
56.9
4k8kB-3uboA:
71.88
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ubo ADENOSINE KINASE

(Sinorhizobium
meliloti)
PF00294
(PfkB)
4 SER A  60
LEU A 131
TYR A 158
PRO A 314
ADN  A 353 (-4.6A)
None
ADN  A 353 (-3.6A)
ADN  A 353 (-4.2A)
0.21A 4k8kB-3uboA:
56.9
4k8kB-3uboA:
71.88
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.
4b2n 70 KDA PROTEIN

(Xanthomonas sp.
35Y)
no annotation 4 SER A 389
LEU A 528
TYR A 367
PRO A 384
None
None
None
HEM  A 701 ( 4.9A)
1.16A 4k8kB-4b2nA:
0.0
4k8kB-4b2nA:
20.09
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4e3a SUGAR KINASE PROTEIN

(Rhizobium etli)
PF00294
(PfkB)
4 SER A  58
LEU A  35
TYR A 156
PRO A 312
ADN  A 500 (-3.3A)
None
ADN  A 500 (-3.8A)
ADN  A 500 (-4.3A)
1.27A 4k8kB-4e3aA:
62.5
4k8kB-4e3aA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4e3a SUGAR KINASE PROTEIN

(Rhizobium etli)
PF00294
(PfkB)
4 SER A  58
LEU A 129
TYR A 156
PRO A 312
ADN  A 500 (-3.3A)
None
ADN  A 500 (-3.8A)
ADN  A 500 (-4.3A)
0.52A 4k8kB-4e3aA:
62.5
4k8kB-4e3aA:
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.
4ph9 PROSTAGLANDIN G/H
SYNTHASE 2


(Mus musculus)
PF00008
(EGF)
PF03098
(An_peroxidase)
4 SER A 456
LEU A 179
TYR A 505
PRO A 219
None
1.48A 4k8kB-4ph9A:
undetectable
4k8kB-4ph9A:
21.35
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.
4q1z PUTATIVE LIPOPROTEIN

(Bacteroides
thetaiotaomicron)
PF16215
(DUF4876)
4 SER A 117
LEU A 257
TYR A 125
PRO A 383
None
1.33A 4k8kB-4q1zA:
undetectable
4k8kB-4q1zA:
21.93
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.
5h65 PROTECTION OF
TELOMERES PROTEIN 1


(Homo sapiens)
no annotation 4 SER A 421
LEU A 452
TYR A 419
PRO A 409
None
1.40A 4k8kB-5h65A:
undetectable
4k8kB-5h65A:
21.77
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.
5ip9 DNA-DIRECTED RNA
POLYMERASE II
SUBUNIT RPB2


(Saccharomyces
cerevisiae)
PF00562
(RNA_pol_Rpb2_6)
PF04560
(RNA_pol_Rpb2_7)
PF04561
(RNA_pol_Rpb2_2)
PF04563
(RNA_pol_Rpb2_1)
PF04565
(RNA_pol_Rpb2_3)
PF04566
(RNA_pol_Rpb2_4)
PF04567
(RNA_pol_Rpb2_5)
4 SER B 546
LEU B 521
TYR B 634
PRO B 411
None
1.45A 4k8kB-5ip9B:
undetectable
4k8kB-5ip9B:
15.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5odr HETERODISULFIDE
REDUCTASE, SUBUNIT A


(Methanothermococcus
thermolithotrophicus)
PF07992
(Pyr_redox_2)
PF13187
(Fer4_9)
4 SER A 492
LEU A 185
TYR A 406
PRO A 335
None
FAD  A 701 (-4.4A)
FAD  A 701 (-3.7A)
None
1.43A 4k8kB-5odrA:
4.7
4k8kB-5odrA:
19.45
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.
5uak CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR


(Homo sapiens)
PF00005
(ABC_tran)
PF00664
(ABC_membrane)
PF14396
(CFTR_R)
4 SER A1058
LEU A 184
TYR A 161
PRO A 499
None
1.45A 4k8kB-5uakA:
undetectable
4k8kB-5uakA:
12.42
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.
5xb7 BETA-GALACTOSIDASE

(Bifidobacterium
animalis)
no annotation 4 SER A 256
LEU A 433
TYR A 250
PRO A 282
None
1.26A 4k8kB-5xb7A:
undetectable
4k8kB-5xb7A:
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.
5xyi UNCHARACTERIZED
PROTEIN


(Trichomonas
vaginalis)
PF00163
(Ribosomal_S4)
PF00333
(Ribosomal_S5)
PF01479
(S4)
PF03719
(Ribosomal_S5_C)
4 SER J  96
LEU J  75
TYR J  93
PRO C 188
None
1.20A 4k8kB-5xyiJ:
undetectable
4k8kB-5xyiJ:
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.
5zvs VP2

(Aquareovirus C)
no annotation 4 SER 2 230
LEU 2 383
TYR 2 271
PRO 2 208
None
1.38A 4k8kB-5zvs2:
undetectable
4k8kB-5zvs2:
14.01
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.
8i1b INTERLEUKIN-1 BETA

(Mus musculus)
PF00340
(IL1)
4 SER A  84
LEU A  20
TYR A  24
PRO A  87
None
1.41A 4k8kB-8i1bA:
undetectable
4k8kB-8i1bA:
19.42