SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '5od2'

List of Similar Pattern of Amino Acids

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 on the DrReposER ID to view details on interfaces and similar patterns of amino acids)
(Click on the view link on the last column to view superposed patterns of amino acids)
Filter list by:
DrReposER ID / Desc. Hit
PDBID		 Hit
Macromolecule		 Res.
Matches		 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.
1BX4_A_ADNA350_1
(PROTEIN (ADENOSINE
KINASE))		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 12 ASP A  28
GLY A 106
GLY A 107
ALA A 201
ASP A 442
 GLC  A 501 (-2.7A)
GLC  A 501 (-3.2A)
GLC  A 501 (-3.7A)
None
GLC  A 501 ( 2.6A)
 0.58A 1bx4A-5od2A:
4.3		 1bx4A-5od2A:
15.09
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.
1EKJ_C_ACTC3007_0
(BETA-CARBONIC
ANHYDRASE)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		4 / 6 ASP A 442
VAL A 438
GLY A 106
GLN A 108
 GLC  A 501 ( 2.6A)
PO4  A 504 ( 4.3A)
GLC  A 501 (-3.2A)
GLC  A 501 (-3.1A)
 1.29A 1ekjC-5od2A:
undetectable
1ekjD-5od2A:
undetectable		 1ekjC-5od2A:
undetectable
1ekjD-5od2A:
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.
1I9G_A_SAMA301_0
(HYPOTHETICAL PROTEIN
RV2118C)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 12 ILE A 353
GLY A 297
SER A 446
ALA A 448
VAL A 306
 None
 1.06A 1i9gA-5od2A:
4.4		 1i9gA-5od2A:
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.
1M4D_A_TOYA500_1
(AMINOGLYCOSIDE
2'-N-ACETYLTRANSFERA
SE)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 10 PHE A 355
SER A 446
SER A 375
ASP A 442
THR A 443
 None
None
None
GLC  A 501 ( 2.6A)
None
 1.45A 1m4dA-5od2A:
undetectable		 1m4dA-5od2A:
14.44
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.
1ONI_A_BEZA502_0
(14.5 KDA
TRANSLATIONAL
INHIBITOR PROTEIN)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		4 / 6 ASN A  24
ASN A  26
ILE A 111
GLY A 106
 None
GLC  A 501 (-3.8A)
None
GLC  A 501 (-3.2A)
 1.08A 1oniA-5od2A:
undetectable
1oniB-5od2A:
undetectable		 1oniA-5od2A:
undetectable
1oniB-5od2A:
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.
1PXX_A_DIFA701_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 10 LEU A 315
TYR A 312
GLY A 331
ALA A 332
LEU A 336
 None
 1.06A 1pxxA-5od2A:
0.6		 1pxxA-5od2A:
8.10
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.
1PXX_C_DIFC2701_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 12 LEU A 315
TYR A 312
GLY A 331
ALA A 332
LEU A 336
 None
 1.06A 1pxxC-5od2A:
0.9		 1pxxC-5od2A:
8.10
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.
1SG9_A_SAMA301_1
(HEMK PROTEIN)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		4 / 4 THR A 196
GLY A 441
ASP A 442
ALA A 274
 None
PO4  A 504 (-3.3A)
GLC  A 501 ( 2.6A)
GLC  A 501 ( 4.3A)
 1.04A 1sg9A-5od2A:
3.9		 1sg9A-5od2A:
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.
1SQ5_D_PAUD6004_0
(PANTOTHENATE KINASE)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 10 VAL A 347
LEU A 307
GLY A 331
TYR A 352
ILE A 329
 None
 1.36A 1sq5D-5od2A:
undetectable		 1sq5D-5od2A:
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.
2BJF_A_DXCA330_0
(CHOLOYLGLYCINE
HYDROLASE)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 12 MET A 105
PHE A  20
ILE A 211
THR A 128
LEU A 131
 None
 1.32A 2bjfA-5od2A:
undetectable		 2bjfA-5od2A:
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.
2EJF_A_ADNA2001_1
(235AA LONG
HYPOTHETICAL
BIOTIN--[ACETYL-COA-
CARBOXYLASE] LIGASE)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		4 / 7 GLU A 272
ALA A  22
ASN A  24
ALA A 109
 None
 1.02A 2ejfA-5od2A:
2.2		 2ejfA-5od2A:
15.77
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.
2PKK_A_2FAA501_1
(ADENOSINE KINASE)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 12 ASP A  28
GLY A 106
ALA A 274
GLY A 439
ASP A 442
 GLC  A 501 (-2.7A)
GLC  A 501 (-3.2A)
GLC  A 501 ( 4.3A)
PO4  A 504 (-3.1A)
GLC  A 501 ( 2.6A)
 1.02A 2pkkA-5od2A:
17.1		 2pkkA-5od2A:
12.12
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.
2PKK_A_2FAA501_1
(ADENOSINE KINASE)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 12 ASP A  28
GLY A 106
GLY A 107
GLY A 439
ASP A 442
 GLC  A 501 (-2.7A)
GLC  A 501 (-3.2A)
GLC  A 501 (-3.7A)
PO4  A 504 (-3.1A)
GLC  A 501 ( 2.6A)
 0.36A 2pkkA-5od2A:
17.1		 2pkkA-5od2A:
12.12
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.
2PKM_A_ADNA501_1
(ADENOSINE KINASE)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 12 ASP A  28
GLY A 106
GLY A 107
GLY A 439
ASP A 442
 GLC  A 501 (-2.7A)
GLC  A 501 (-3.2A)
GLC  A 501 (-3.7A)
PO4  A 504 (-3.1A)
GLC  A 501 ( 2.6A)
 0.37A 2pkmA-5od2A:
4.2		 2pkmA-5od2A:
12.12
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.
2YJA_B_ESTB1550_1
(ESTROGEN RECEPTOR)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 12 ALA A  22
LEU A  19
ILE A 267
GLY A 223
LEU A 219
 None
 1.12A 2yjaB-5od2A:
undetectable		 2yjaB-5od2A:
14.35
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.
2ZGW_A_ADNA1301_1
(BIOTIN--[ACETYL-COA-
CARBOXYLASE] LIGASE)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		4 / 7 GLU A 272
ALA A  22
ASN A  24
ALA A 109
 None
 1.04A 2zgwA-5od2A:
3.8		 2zgwA-5od2A:
15.77
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.
2ZGW_B_ADNB1302_1
(BIOTIN--[ACETYL-COA-
CARBOXYLASE] LIGASE)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		4 / 6 GLU A 272
ALA A  22
ASN A  24
ALA A 109
 None
 1.06A 2zgwB-5od2A:
3.7		 2zgwB-5od2A:
15.77
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.
2ZZM_A_SAMA401_0
(UNCHARACTERIZED
PROTEIN MJ0883)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 12 LEU A 354
ILE A 309
ASN A 305
LEU A 335
PHE A 339
 None
 1.23A 2zzmA-5od2A:
3.7		 2zzmA-5od2A:
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.
3CLB_D_TMQD614_1
(DHFR-TS)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 10 ALA A  22
ILE A 211
ILE A 258
TYR A 234
THR A  21
 None
 1.18A 3clbD-5od2A:
undetectable		 3clbD-5od2A:
9.02
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.
3HBB_D_TMQD614_1
(DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 10 ALA A  22
ILE A 211
ILE A 258
TYR A 234
THR A  21
 None
 1.18A 3hbbD-5od2A:
undetectable		 3hbbD-5od2A:
9.02
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.
3N8Z_B_FLPB1701_1
(PROSTAGLANDIN G/H
SYNTHASE 1)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 12 VAL A 347
LEU A 315
ILE A 329
GLY A 331
ALA A 332
 None
 0.83A 3n8zB-5od2A:
undetectable		 3n8zB-5od2A:
10.31
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.
3UBO_A_ADNA353_1
(ADENOSINE KINASE)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		6 / 12 ASP A  28
GLY A 106
GLY A 107
ARG A 197
GLY A 439
ASP A 442
 GLC  A 501 (-2.7A)
GLC  A 501 (-3.2A)
GLC  A 501 (-3.7A)
PO4  A 504 (-3.7A)
PO4  A 504 (-3.1A)
GLC  A 501 ( 2.6A)
 0.61A 3uboA-5od2A:
22.7		 3uboA-5od2A:
12.65
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.
3UM5_B_CP6B709_1
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 10 PHE A 251
SER A 277
ILE A 276
ILE A 237
TYR A 241
 None
 1.31A 3um5B-5od2A:
undetectable		 3um5B-5od2A:
9.91
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.
3UQ6_A_ADNA401_1
(ADENOSINE KINASE,
PUTATIVE)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 12 ASP A  28
GLY A 106
GLY A 107
GLY A 439
ASP A 442
 GLC  A 501 (-2.7A)
GLC  A 501 (-3.2A)
GLC  A 501 (-3.7A)
PO4  A 504 (-3.1A)
GLC  A 501 ( 2.6A)
 0.47A 3uq6A-5od2A:
22.3		 3uq6A-5od2A:
14.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3VAQ_A_ADNA401_1
(PUTATIVE ADENOSINE
KINASE)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 12 ASP A  28
GLY A 106
GLY A 107
GLY A 439
ASP A 442
 GLC  A 501 (-2.7A)
GLC  A 501 (-3.2A)
GLC  A 501 (-3.7A)
PO4  A 504 (-3.1A)
GLC  A 501 ( 2.6A)
 0.51A 3vaqA-5od2A:
20.7		 3vaqA-5od2A:
14.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3VAS_A_ADNA401_1
(PUTATIVE ADENOSINE
KINASE)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 12 ASP A  28
GLY A 106
GLY A 107
GLY A 439
ASP A 442
 GLC  A 501 (-2.7A)
GLC  A 501 (-3.2A)
GLC  A 501 (-3.7A)
PO4  A 504 (-3.1A)
GLC  A 501 ( 2.6A)
 0.50A 3vasA-5od2A:
20.8		 3vasA-5od2A:
14.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3VAS_B_ADNB401_1
(PUTATIVE ADENOSINE
KINASE)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 12 ASP A  28
GLY A 106
GLY A 107
GLY A 439
ASP A 442
 GLC  A 501 (-2.7A)
GLC  A 501 (-3.2A)
GLC  A 501 (-3.7A)
PO4  A 504 (-3.1A)
GLC  A 501 ( 2.6A)
 0.55A 3vasB-5od2A:
20.4		 3vasB-5od2A:
14.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4B9Z_A_ACRA1818_1
(ALPHA-GLUCOSIDASE,
PUTATIVE, ADG31B)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 12 LEU A  91
ILE A  61
ASP A  66
ARG A  53
PHE A  45
 None
 1.30A 4b9zA-5od2A:
2.4		 4b9zA-5od2A:
7.51
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.
4DC3_B_2FAB401_1
(ADENOSINE KINASE)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 12 ASP A  28
GLY A 106
GLY A 107
GLY A 439
ASP A 442
 GLC  A 501 (-2.7A)
GLC  A 501 (-3.2A)
GLC  A 501 (-3.7A)
PO4  A 504 (-3.1A)
GLC  A 501 ( 2.6A)
 0.48A 4dc3B-5od2A:
20.6		 4dc3B-5od2A:
14.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4E3A_B_ADNB500_1
(SUGAR KINASE PROTEIN)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 12 ASP A  28
GLY A 106
GLY A 107
GLY A 439
ASP A 442
 GLC  A 501 (-2.7A)
GLC  A 501 (-3.2A)
GLC  A 501 (-3.7A)
PO4  A 504 (-3.1A)
GLC  A 501 ( 2.6A)
 0.40A 4e3aB-5od2A:
22.7		 4e3aB-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.
4IIL_A_RBFA401_2
(MEMBRANE LIPOPROTEIN
TPN38(B))		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		4 / 8 PRO A 129
ASN A  26
GLN A 108
ILE A 209
 None
GLC  A 501 (-3.8A)
GLC  A 501 (-3.1A)
None
 1.08A 4iilA-5od2A:
4.1		 4iilA-5od2A:
10.66
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.
4JKS_A_ADNA401_1
(PROBABLE SUGAR
KINASE PROTEIN)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 12 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)
 0.48A 4jksA-5od2A:
22.8		 4jksA-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.
4JKS_B_ADNB401_1
(PROBABLE SUGAR
KINASE PROTEIN)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 12 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)
 0.48A 4jksB-5od2A:
22.8		 4jksB-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.
4JKU_A_ADNA500_1
(PROBABLE SUGAR
KINASE PROTEIN)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 12 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 4jkuA-5od2A:
22.7		 4jkuA-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.
4K8C_A_ADNA401_1
(SUGAR KINASE)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 12 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)
 0.47A 4k8cA-5od2A:
22.8		 4k8cA-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.
4K8C_B_ADNB401_1
(SUGAR KINASE)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 12 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)
 0.47A 4k8cB-5od2A:
22.7		 4k8cB-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.
4K8K_A_ADNA401_1
(SUGAR KINASE)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 12 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 4k8kA-5od2A:
23.0		 4k8kA-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.
4K8K_B_ADNB403_1
(SUGAR KINASE)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 12 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.
4KAH_A_ADNA401_1
(PROBABLE SUGAR
KINASE PROTEIN)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 12 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)
 0.47A 4kahA-5od2A:
22.9		 4kahA-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.
4KAH_B_ADNB502_1
(PROBABLE SUGAR
KINASE PROTEIN)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 12 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)
 0.47A 4kahB-5od2A:
22.7		 4kahB-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.
4KAL_A_ADNA401_1
(PROBABLE SUGAR
KINASE PROTEIN)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 12 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)
 0.48A 4kalA-5od2A:
22.7		 4kalA-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.
4KAL_B_ADNB401_1
(PROBABLE SUGAR
KINASE PROTEIN)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 12 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)
 0.48A 4kalB-5od2A:
22.7		 4kalB-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.
4KAN_A_ADNA401_1
(PROBABLE SUGAR
KINASE PROTEIN)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 12 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)
 0.47A 4kanA-5od2A:
22.9		 4kanA-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.
4KAN_B_ADNB401_1
(PROBABLE SUGAR
KINASE PROTEIN)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 12 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)
 0.47A 4kanB-5od2A:
22.8		 4kanB-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.
4KBE_A_ADNA401_1
(PROBABLE SUGAR
KINASE PROTEIN)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 12 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)
 0.47A 4kbeA-5od2A:
22.9		 4kbeA-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.
4KBE_B_ADNB401_1
(PROBABLE SUGAR
KINASE PROTEIN)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 12 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)
 0.45A 4kbeB-5od2A:
22.8		 4kbeB-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.
4KR4_C_AICC401_1
(OUTER MEMBRANE
PROTEIN F)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		4 / 8 ARG A  70
TYR A  57
ARG A  59
ARG A 282
 None
 1.31A 4kr4C-5od2A:
undetectable		 4kr4C-5od2A:
13.13
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.
4KR4_C_AICC401_1
(OUTER MEMBRANE
PROTEIN F)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		4 / 8 ARG A  70
TYR A  57
ARG A  59
GLU A  82
 None
None
None
GLC  A 501 (-2.9A)
 1.34A 4kr4C-5od2A:
undetectable		 4kr4C-5od2A:
13.13
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.
4LBG_A_ADNA401_1
(PROBABLE SUGAR
KINASE PROTEIN)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 12 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)
 0.48A 4lbgA-5od2A:
22.8		 4lbgA-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.
4LBG_B_ADNB401_1
(PROBABLE SUGAR
KINASE PROTEIN)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 12 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)
 0.48A 4lbgB-5od2A:
22.8		 4lbgB-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.
4LCA_A_ADNA401_1
(PROBABLE SUGAR
KINASE PROTEIN)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 12 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)
 0.46A 4lcaA-5od2A:
22.7		 4lcaA-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.
4LCA_B_ADNB401_1
(PROBABLE SUGAR
KINASE PROTEIN)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 12 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)
 0.46A 4lcaB-5od2A:
22.7		 4lcaB-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.
4N09_A_ADNA401_1
(ADENOSINE KINASE)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 12 ASP A  28
GLY A 107
ALA A 201
GLY A 439
ASP A 442
 GLC  A 501 (-2.7A)
GLC  A 501 (-3.7A)
None
PO4  A 504 (-3.1A)
GLC  A 501 ( 2.6A)
 0.81A 4n09A-5od2A:
22.4		 4n09A-5od2A:
14.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4N09_B_ADNB401_1
(ADENOSINE KINASE)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 12 ASP A  28
GLY A 106
GLY A 107
ALA A 201
ASP A 442
 GLC  A 501 (-2.7A)
GLC  A 501 (-3.2A)
GLC  A 501 (-3.7A)
None
GLC  A 501 ( 2.6A)
 0.61A 4n09B-5od2A:
22.4		 4n09B-5od2A:
14.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4N09_B_ADNB401_1
(ADENOSINE KINASE)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 12 ASP A  28
GLY A 107
ALA A 201
GLY A 439
ASP A 442
 GLC  A 501 (-2.7A)
GLC  A 501 (-3.7A)
None
PO4  A 504 (-3.1A)
GLC  A 501 ( 2.6A)
 0.89A 4n09B-5od2A:
22.4		 4n09B-5od2A:
14.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4N09_D_ADND401_1
(ADENOSINE KINASE)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 12 ASP A  28
GLY A 106
GLY A 107
ALA A 201
ASP A 442
 GLC  A 501 (-2.7A)
GLC  A 501 (-3.2A)
GLC  A 501 (-3.7A)
None
GLC  A 501 ( 2.6A)
 0.61A 4n09D-5od2A:
22.2		 4n09D-5od2A:
14.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4N09_D_ADND401_1
(ADENOSINE KINASE)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 12 ASP A  28
GLY A 107
ALA A 201
GLY A 439
ASP A 442
 GLC  A 501 (-2.7A)
GLC  A 501 (-3.7A)
None
PO4  A 504 (-3.1A)
GLC  A 501 ( 2.6A)
 0.90A 4n09D-5od2A:
22.2		 4n09D-5od2A:
14.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4P68_A_MTXA201_1
(DIHYDROFOLATE
REDUCTASE)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 11 PHE A 251
SER A 277
ILE A 276
ILE A 237
TYR A 241
 None
 1.37A 4p68A-5od2A:
undetectable		 4p68A-5od2A:
19.50
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.
4QOG_B_ML1B302_1
(RIBOSYLDIHYDRONICOTI
NAMIDE DEHYDROGENASE
[QUINONE])		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		4 / 6 GLY A 447
GLN A 346
PHE A 355
ILE A 353
 None
 1.04A 4qogA-5od2A:
4.5
4qogB-5od2A:
4.8		 4qogA-5od2A:
18.07
4qogB-5od2A:
18.07
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.
4R21_A_STRA601_1
(CYTOCHROME P450
FAMILY 17
POLYPEPTIDE 2)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		4 / 6 ILE A 319
GLY A 331
ILE A 423
VAL A 347
 None
 0.81A 4r21A-5od2A:
undetectable		 4r21A-5od2A:
10.68
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.
4RRX_A_LURA706_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 12 LEU A 315
TYR A 312
GLY A 331
ALA A 332
LEU A 336
 None
 1.05A 4rrxA-5od2A:
undetectable		 4rrxA-5od2A:
8.33
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.
4RRX_B_LURB706_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 12 LEU A 315
TYR A 312
GLY A 331
ALA A 332
LEU A 336
 None
 0.95A 4rrxB-5od2A:
undetectable		 4rrxB-5od2A:
8.33
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.
4RTR_A_SAMA301_0
(DNA ADENINE
METHYLASE)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 11 PHE A 139
ILE A 124
ASN A 144
SER A 113
TYR A 164
 None
 1.39A 4rtrA-5od2A:
3.7		 4rtrA-5od2A:
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.
4X1I_B_LOCB502_2
(TUBULIN BETA CHAIN)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 12 LYS A 340
LEU A 342
ASN A 341
THR A 269
VAL A 286
 None
 1.19A 4x1iB-5od2A:
4.4		 4x1iB-5od2A:
9.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4X5I_A_FOLA201_1
(DIHYDROFOLATE
REDUCTASE)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		3 / 3 ASP A 313
ARG A  59
ARG A 282
 None
 0.90A 4x5iA-5od2A:
undetectable		 4x5iA-5od2A:
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.
5DXB_B_ESTB601_1
(ESTROGEN RECEPTOR)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 11 ALA A  22
LEU A  19
ILE A 267
GLY A 223
LEU A 219
 None
 1.07A 5dxbB-5od2A:
undetectable		 5dxbB-5od2A:
14.83
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.
5ERG_B_SAMB401_0
(TRNA
(ADENINE(58)-N(1))-M
ETHYLTRANSFERASE
CATALYTIC SUBUNIT
TRM61)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 12 ILE A 111
VAL A 112
GLY A 107
VAL A 285
LEU A 271
 None
None
GLC  A 501 (-3.7A)
None
None
 1.18A 5ergB-5od2A:
4.2		 5ergB-5od2A:
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.
5F1A_B_SALB601_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		4 / 7 VAL A 347
LEU A 315
GLY A 331
ALA A 332
 None
 0.91A 5f1aB-5od2A:
undetectable		 5f1aB-5od2A:
10.71
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.
5GS4_A_ESTA603_1
(ESTROGEN RECEPTOR)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 12 ALA A  22
LEU A  19
ILE A 267
GLY A 223
LEU A 219
 None
 1.16A 5gs4A-5od2A:
undetectable		 5gs4A-5od2A:
14.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5GTR_A_ESTA601_1
(ESTROGEN RECEPTOR)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 12 ALA A  22
LEU A  19
ILE A 267
GLY A 223
LEU A 219
 None
 0.92A 5gtrA-5od2A:
undetectable		 5gtrA-5od2A:
14.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5IKQ_B_JMSB602_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 12 LEU A 315
TYR A 312
GLY A 331
ALA A 332
LEU A 336
 None
 1.13A 5ikqB-5od2A:
undetectable		 5ikqB-5od2A:
10.73
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.
5KB5_A_ADNA401_1
(ADENOSINE KINASE)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 12 ASP A  28
GLY A 106
ALA A 201
GLY A 439
ASP A 442
 GLC  A 501 (-2.7A)
GLC  A 501 (-3.2A)
None
PO4  A 504 (-3.1A)
GLC  A 501 ( 2.6A)
 0.54A 5kb5A-5od2A:
23.5		 5kb5A-5od2A:
15.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5KB5_A_ADNA401_1
(ADENOSINE KINASE)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 12 ASP A  28
GLY A 106
GLY A 107
GLY A 439
ASP A 442
 GLC  A 501 (-2.7A)
GLC  A 501 (-3.2A)
GLC  A 501 (-3.7A)
PO4  A 504 (-3.1A)
GLC  A 501 ( 2.6A)
 0.42A 5kb5A-5od2A:
23.5		 5kb5A-5od2A:
15.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5KB5_A_ADNA401_1
(ADENOSINE KINASE)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 12 ASP A 442
GLY A 439
ALA A 274
GLY A 106
ASP A  28
 GLC  A 501 ( 2.6A)
PO4  A 504 (-3.1A)
GLC  A 501 ( 4.3A)
GLC  A 501 (-3.2A)
GLC  A 501 (-2.7A)
 0.71A 5kb5A-5od2A:
23.5		 5kb5A-5od2A:
15.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5KR0_A_478A101_1
(PROTEASE E35D-APV)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 9 ASN A 172
ALA A 201
GLY A 233
VAL A 438
ILE A 199
 GLC  A 501 (-4.1A)
None
None
PO4  A 504 ( 4.3A)
GLC  A 501 ( 4.4A)
 1.17A 5kr0A-5od2A:
undetectable		 5kr0A-5od2A:
27.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5M54_B_TA1B502_1
(TUBULIN BETA-2B
CHAIN)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 12 HIS A  73
ALA A  81
SER A 275
PHE A 198
ARG A  59
 None
 1.25A 5m54B-5od2A:
4.4		 5m54B-5od2A:
11.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5M54_E_TA1E502_1
(TUBULIN BETA-2B
CHAIN)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 12 HIS A  73
ALA A  81
SER A 275
PHE A 198
ARG A  59
 None
 1.26A 5m54E-5od2A:
3.4		 5m54E-5od2A:
11.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5NN8_A_ACRA1015_1
(LYSOSOMAL
ALPHA-GLUCOSIDASE)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 12 LEU A  91
ILE A  61
ASP A  66
ARG A  53
PHE A  45
 None
 1.14A 5nn8A-5od2A:
undetectable		 5nn8A-5od2A:
6.10
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.
5TL8_A_X2NA502_2
(PROTEIN CYP51)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		4 / 6 PRO A  64
LEU A  65
PHE A  67
LEU A  91
 None
 0.89A 5tl8A-5od2A:
undetectable		 5tl8A-5od2A:
12.29
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.
5TWJ_C_SAMC201_0
(RIBOSOMAL RNA LARGE
SUBUNIT
METHYLTRANSFERASE H)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 12 LEU A 342
SER A 291
LEU A 290
LEU A 271
VAL A 296
 None
 1.17A 5twjC-5od2A:
undetectable		 5twjC-5od2A:
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.
5VOP_A_C2FA3001_0
(5-METHYLTETRAHYDROFO
LATE HOMOCYSTEINE
S-METHYLTRANSFERASE)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 12 GLY A 233
ASP A 442
GLY A 106
ASN A  26
ILE A 111
 None
GLC  A 501 ( 2.6A)
GLC  A 501 (-3.2A)
GLC  A 501 (-3.8A)
None
 0.83A 5vopA-5od2A:
3.0		 5vopA-5od2A:
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.
5VOP_B_C2FB3001_0
(5-METHYLTETRAHYDROFO
LATE HOMOCYSTEINE
S-METHYLTRANSFERASE)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 12 GLY A 233
ASP A 442
GLY A 106
ASN A  26
ILE A 111
 None
GLC  A 501 ( 2.6A)
GLC  A 501 (-3.2A)
GLC  A 501 (-3.8A)
None
 0.83A 5vopB-5od2A:
2.7		 5vopB-5od2A:
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.
6BEC_C_RBTC601_1
(SCAFFOLD PROTEIN D13)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 12 VAL A 200
PHE A  45
PRO A  64
ILE A  85
PHE A  67
 None
 1.26A 6becA-5od2A:
undetectable
6becB-5od2A:
undetectable
6becC-5od2A:
undetectable		 6becA-5od2A:
8.88
6becB-5od2A:
8.88
6becC-5od2A:
8.88
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.
6DEB_B_MTXB302_1
(BIFUNCTIONAL PROTEIN
FOLD)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		5 / 12 LEU A 394
PHE A 374
SER A 454
ILE A  14
VAL A 450
 None
 1.10A 6debB-5od2A:
4.0		 6debB-5od2A:
18.48
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.
6HAU_B_ACTB502_0
(MRNA EXPORT FACTOR
ICP27 HOMOLOG)		 5od2 BIFUNCTIONAL
ADP-SPECIFIC
GLUCOKINASE/PHOSPHOF
RUCTOKINASE
(Methanocaldococc
us
jannaschii) 		4 / 4 LEU A 219
TYR A  23
ARG A 253
ASP A 257
 None
 1.31A 6hauA-5od2A:
0.0
6hauB-5od2A:
0.0		 6hauA-5od2A:
undetectable
6hauB-5od2A:
undetectable