SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3kh5'

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.
1A7Y_A_DVAA8_0
(ACTINOMYCIN D)		 3kh5 PROTEIN MJ1225
(Methanocaldococc
us
jannaschii) 		3 / 3 THR A  20
THR A  21
PRO A  19
 None
 0.83A 1a7yA-3kh5A:
undetectable		 1a7yA-3kh5A:
3.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1I3W_E_DVAE2_0
(ACTINOMYCIN D)		 3kh5 PROTEIN MJ1225
(Methanocaldococc
us
jannaschii) 		3 / 3 THR A  21
PRO A  19
THR A  20
 None
 0.83A 1i3wE-3kh5A:
undetectable		 1i3wE-3kh5A:
3.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1I3W_E_DVAE8_0
(ACTINOMYCIN D)		 3kh5 PROTEIN MJ1225
(Methanocaldococc
us
jannaschii) 		3 / 3 THR A  20
THR A  21
PRO A  19
 None
 0.85A 1i3wE-3kh5A:
undetectable		 1i3wE-3kh5A:
3.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1I3W_F_DVAF8_0
(ACTINOMYCIN D)		 3kh5 PROTEIN MJ1225
(Methanocaldococc
us
jannaschii) 		3 / 3 THR A  20
THR A  21
PRO A  19
 None
 0.80A 1i3wF-3kh5A:
undetectable		 1i3wF-3kh5A:
3.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1I3W_G_DVAG2_0
(ACTINOMYCIN D)		 3kh5 PROTEIN MJ1225
(Methanocaldococc
us
jannaschii) 		3 / 3 THR A  21
PRO A  19
THR A  20
 None
 0.87A 1i3wG-3kh5A:
undetectable		 1i3wG-3kh5A:
3.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1I3W_G_DVAG8_0
(ACTINOMYCIN D)		 3kh5 PROTEIN MJ1225
(Methanocaldococc
us
jannaschii) 		3 / 3 THR A  20
THR A  21
PRO A  19
 None
 0.86A 1i3wG-3kh5A:
undetectable		 1i3wG-3kh5A:
3.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1MNV_D_DVAD2_0
(ACTINOMYCIN D)		 3kh5 PROTEIN MJ1225
(Methanocaldococc
us
jannaschii) 		3 / 3 THR A  21
PRO A  19
THR A  20
 None
 0.82A 1mnvD-3kh5A:
undetectable		 1mnvD-3kh5A:
3.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1MNV_D_DVAD8_0
(ACTINOMYCIN D)		 3kh5 PROTEIN MJ1225
(Methanocaldococc
us
jannaschii) 		3 / 3 THR A  20
THR A  21
PRO A  19
 None
 0.77A 1mnvD-3kh5A:
undetectable		 1mnvD-3kh5A:
3.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1OVF_B_DVAB2_0
(ACTINOMYCIN D)		 3kh5 PROTEIN MJ1225
(Methanocaldococc
us
jannaschii) 		3 / 3 THR A  21
PRO A  19
THR A  20
 None
 0.85A 1ovfB-3kh5A:
undetectable		 1ovfB-3kh5A:
3.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1QFI_A_DVAA8_0
(ACTINOMYCIN X2)		 3kh5 PROTEIN MJ1225
(Methanocaldococc
us
jannaschii) 		3 / 3 THR A  20
THR A  21
PRO A  19
 None
 0.80A 1qfiA-3kh5A:
undetectable		 1qfiA-3kh5A:
3.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1UNJ_F_DVAF8_0
(7-AMINO-ACTINOMYCIN
D)		 3kh5 PROTEIN MJ1225
(Methanocaldococc
us
jannaschii) 		3 / 3 THR A  20
THR A  21
PRO A  19
 None
 0.84A 1unjF-3kh5A:
undetectable		 1unjF-3kh5A:
3.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1X7P_B_SAMB302_0
(RRNA
METHYLTRANSFERASE)		 3kh5 PROTEIN MJ1225
(Methanocaldococc
us
jannaschii) 		6 / 10 ASP A 274
GLY A 268
ILE A 245
MET A 249
LEU A 257
ALA A 236
 ADP  A 284 (-2.8A)
None
None
None
AMP  A 282 ( 4.8A)
None
 1.36A 1x7pA-3kh5A:
undetectable
1x7pB-3kh5A:
undetectable		 1x7pA-3kh5A:
22.26
1x7pB-3kh5A:
22.26
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.
209D_C_DVAC8_0
(N8-ACTINOMYCIN D)		 3kh5 PROTEIN MJ1225
(Methanocaldococc
us
jannaschii) 		3 / 3 THR A  20
THR A  22
PRO A  85
 None
 0.87A 209dC-3kh5A:
undetectable		 209dC-3kh5A:
3.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2VDB_A_NPSA1591_1
(SERUM ALBUMIN)		 3kh5 PROTEIN MJ1225
(Methanocaldococc
us
jannaschii) 		4 / 8 ILE A 220
HIS A 211
ARG A 218
GLY A 215
 None
 0.96A 2vdbA-3kh5A:
undetectable		 2vdbA-3kh5A:
19.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2W3M_A_FOLA1188_0
(DIHYDROFOLATE
REDUCTASE)		 3kh5 PROTEIN MJ1225
(Methanocaldococc
us
jannaschii) 		5 / 12 ILE A  70
LEU A 167
PHE A  78
ILE A 200
LEU A  27
 None
 1.10A 2w3mA-3kh5A:
undetectable		 2w3mA-3kh5A:
24.39
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.
2XN5_A_FUNA1356_2
(THYROXINE-BINDING
GLOBULIN)		 3kh5 PROTEIN MJ1225
(Methanocaldococc
us
jannaschii) 		3 / 3 LEU A  38
ARG A  36
ILE A  52
 None
 0.55A 2xn5B-3kh5A:
undetectable		 2xn5B-3kh5A:
8.21
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2YZQ_A_SAMA6075_0
(PUTATIVE
UNCHARACTERIZED
PROTEIN PH1780)		 3kh5 PROTEIN MJ1225
(Methanocaldococc
us
jannaschii) 		6 / 12 ILE A 193
THR A 197
VAL A 233
ILE A 234
ILE A 254
PRO A 258
 AMP  A 282 ( 4.3A)
AMP  A 282 (-3.9A)
AMP  A 282 (-3.8A)
AMP  A 282 (-3.9A)
AMP  A 282 (-4.1A)
None
 0.56A 2yzqA-3kh5A:
21.0		 2yzqA-3kh5A:
31.07
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2YZQ_A_SAMA6075_0
(PUTATIVE
UNCHARACTERIZED
PROTEIN PH1780)		 3kh5 PROTEIN MJ1225
(Methanocaldococc
us
jannaschii) 		5 / 12 ILE A 269
THR A 155
VAL A 158
ILE A 159
PRO A 183
 ADP  A 284 ( 4.3A)
ADP  A 284 (-3.2A)
ADP  A 284 (-3.9A)
ADP  A 284 (-4.2A)
None
 0.34A 2yzqA-3kh5A:
21.0		 2yzqA-3kh5A:
31.07
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2YZQ_A_SAMA6075_0
(PUTATIVE
UNCHARACTERIZED
PROTEIN PH1780)		 3kh5 PROTEIN MJ1225
(Methanocaldococc
us
jannaschii) 		5 / 12 VAL A 233
ILE A 234
ILE A 254
GLU A 272
PRO A 258
 AMP  A 282 (-3.8A)
AMP  A 282 (-3.9A)
AMP  A 282 (-4.1A)
None
None
 1.03A 2yzqA-3kh5A:
21.0		 2yzqA-3kh5A:
31.07
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.
3A27_A_SAMA250_1
(UNCHARACTERIZED
PROTEIN MJ1557)		 3kh5 PROTEIN MJ1225
(Methanocaldococc
us
jannaschii) 		3 / 3 MET A 249
GLU A 133
ASN A 114
 None
ADP  A 284 ( 4.6A)
ADP  A 284 ( 4.9A)
 1.12A 3a27A-3kh5A:
undetectable		 3a27A-3kh5A:
23.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3A51_E_VDYE6178_1
(VITAMIN D
HYDROXYLASE)		 3kh5 PROTEIN MJ1225
(Methanocaldococc
us
jannaschii) 		5 / 12 ILE A 269
ALA A 236
VAL A 233
PRO A 183
LEU A 190
 ADP  A 284 ( 4.3A)
None
AMP  A 282 (-3.8A)
None
None
 0.93A 3a51E-3kh5A:
undetectable		 3a51E-3kh5A:
19.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3EM0_B_CHDB151_0
(ILEAL BILE
ACID-BINDING PROTEIN)		 3kh5 PROTEIN MJ1225
(Methanocaldococc
us
jannaschii) 		5 / 12 ILE A 245
ILE A 270
GLY A 268
LEU A 190
PRO A 183
 None
 1.17A 3em0B-3kh5A:
undetectable		 3em0B-3kh5A:
17.56
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.
3KPB_A_SAMA1000_0
(UNCHARACTERIZED
PROTEIN MJ0100)		 3kh5 PROTEIN MJ1225
(Methanocaldococc
us
jannaschii) 		6 / 12 ILE A  51
THR A  53
ASP A  56
VAL A  94
ILE A  95
PRO A 119
 ADP  A 283 ( 4.2A)
ADP  A 283 (-2.7A)
ADP  A 283 (-2.8A)
ADP  A 283 (-3.7A)
ADP  A 283 (-3.8A)
None
 0.37A 3kpbA-3kh5A:
12.9		 3kpbA-3kh5A:
21.71
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.
3KPB_A_SAMA1000_0
(UNCHARACTERIZED
PROTEIN MJ0100)		 3kh5 PROTEIN MJ1225
(Methanocaldococc
us
jannaschii) 		8 / 12 ILE A 193
THR A 195
ASP A 198
LYS A 201
VAL A 233
ILE A 234
ILE A 254
PRO A 258
 AMP  A 282 ( 4.3A)
AMP  A 282 (-3.1A)
AMP  A 282 (-3.1A)
AMP  A 282 ( 3.7A)
AMP  A 282 (-3.8A)
AMP  A 282 (-3.9A)
AMP  A 282 (-4.1A)
None
 0.88A 3kpbA-3kh5A:
12.9		 3kpbA-3kh5A:
21.71
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.
3KPB_A_SAMA1000_0
(UNCHARACTERIZED
PROTEIN MJ0100)		 3kh5 PROTEIN MJ1225
(Methanocaldococc
us
jannaschii) 		8 / 12 ILE A 269
THR A 271
ASP A 274
LYS A 277
THR A 155
VAL A 158
ILE A 159
PRO A 183
 ADP  A 284 ( 4.3A)
ADP  A 284 (-3.4A)
ADP  A 284 (-2.8A)
ADP  A 284 (-3.5A)
ADP  A 284 (-3.2A)
ADP  A 284 (-3.9A)
ADP  A 284 (-4.2A)
None
 0.57A 3kpbA-3kh5A:
12.9		 3kpbA-3kh5A:
21.71
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.
3KPB_C_SAMC1000_0
(UNCHARACTERIZED
PROTEIN MJ0100)		 3kh5 PROTEIN MJ1225
(Methanocaldococc
us
jannaschii) 		5 / 12 ILE A  51
LYS A  66
VAL A  94
ILE A  95
PRO A 119
 ADP  A 283 ( 4.2A)
ADP  A 283 ( 4.4A)
ADP  A 283 (-3.7A)
ADP  A 283 (-3.8A)
None
 1.11A 3kpbC-3kh5A:
12.9		 3kpbC-3kh5A:
21.71
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.
3KPB_C_SAMC1000_0
(UNCHARACTERIZED
PROTEIN MJ0100)		 3kh5 PROTEIN MJ1225
(Methanocaldococc
us
jannaschii) 		6 / 12 ILE A  51
THR A  53
ASP A  56
VAL A  94
ILE A  95
PRO A 119
 ADP  A 283 ( 4.2A)
ADP  A 283 (-2.7A)
ADP  A 283 (-2.8A)
ADP  A 283 (-3.7A)
ADP  A 283 (-3.8A)
None
 0.35A 3kpbC-3kh5A:
12.9		 3kpbC-3kh5A:
21.71
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.
3KPB_C_SAMC1000_0
(UNCHARACTERIZED
PROTEIN MJ0100)		 3kh5 PROTEIN MJ1225
(Methanocaldococc
us
jannaschii) 		8 / 12 ILE A 193
THR A 195
ASP A 198
LYS A 201
VAL A 233
ILE A 234
ILE A 254
PRO A 258
 AMP  A 282 ( 4.3A)
AMP  A 282 (-3.1A)
AMP  A 282 (-3.1A)
AMP  A 282 ( 3.7A)
AMP  A 282 (-3.8A)
AMP  A 282 (-3.9A)
AMP  A 282 (-4.1A)
None
 0.95A 3kpbC-3kh5A:
12.9		 3kpbC-3kh5A:
21.71
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.
3KPB_C_SAMC1000_0
(UNCHARACTERIZED
PROTEIN MJ0100)		 3kh5 PROTEIN MJ1225
(Methanocaldococc
us
jannaschii) 		8 / 12 ILE A 269
THR A 271
ASP A 274
LYS A 277
THR A 155
VAL A 158
ILE A 159
PRO A 183
 ADP  A 284 ( 4.3A)
ADP  A 284 (-3.4A)
ADP  A 284 (-2.8A)
ADP  A 284 (-3.5A)
ADP  A 284 (-3.2A)
ADP  A 284 (-3.9A)
ADP  A 284 (-4.2A)
None
 0.55A 3kpbC-3kh5A:
12.9		 3kpbC-3kh5A:
21.71
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.
3KPB_D_SAMD1000_0
(UNCHARACTERIZED
PROTEIN MJ0100)		 3kh5 PROTEIN MJ1225
(Methanocaldococc
us
jannaschii) 		5 / 10 ILE A  51
THR A  53
ASP A  56
VAL A  94
ILE A  95
 ADP  A 283 ( 4.2A)
ADP  A 283 (-2.7A)
ADP  A 283 (-2.8A)
ADP  A 283 (-3.7A)
ADP  A 283 (-3.8A)
 0.31A 3kpbD-3kh5A:
12.9		 3kpbD-3kh5A:
21.71
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.
3KPB_D_SAMD1000_0
(UNCHARACTERIZED
PROTEIN MJ0100)		 3kh5 PROTEIN MJ1225
(Methanocaldococc
us
jannaschii) 		6 / 10 ILE A 193
THR A 195
ASP A 198
LYS A 201
VAL A 233
ILE A 234
 AMP  A 282 ( 4.3A)
AMP  A 282 (-3.1A)
AMP  A 282 (-3.1A)
AMP  A 282 ( 3.7A)
AMP  A 282 (-3.8A)
AMP  A 282 (-3.9A)
 0.91A 3kpbD-3kh5A:
12.9		 3kpbD-3kh5A:
21.71
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.
3KPB_D_SAMD1000_0
(UNCHARACTERIZED
PROTEIN MJ0100)		 3kh5 PROTEIN MJ1225
(Methanocaldococc
us
jannaschii) 		6 / 10 ILE A 193
THR A 195
ASP A 198
VAL A 233
ILE A 234
ILE A 254
 AMP  A 282 ( 4.3A)
AMP  A 282 (-3.1A)
AMP  A 282 (-3.1A)
AMP  A 282 (-3.8A)
AMP  A 282 (-3.9A)
AMP  A 282 (-4.1A)
 0.39A 3kpbD-3kh5A:
12.9		 3kpbD-3kh5A:
21.71
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.
3KPB_D_SAMD1000_0
(UNCHARACTERIZED
PROTEIN MJ0100)		 3kh5 PROTEIN MJ1225
(Methanocaldococc
us
jannaschii) 		7 / 10 ILE A 269
THR A 271
ASP A 274
LYS A 277
THR A 155
VAL A 158
ILE A 159
 ADP  A 284 ( 4.3A)
ADP  A 284 (-3.4A)
ADP  A 284 (-2.8A)
ADP  A 284 (-3.5A)
ADP  A 284 (-3.2A)
ADP  A 284 (-3.9A)
ADP  A 284 (-4.2A)
 0.58A 3kpbD-3kh5A:
12.9		 3kpbD-3kh5A:
21.71
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.
3KPC_A_SAMA1000_0
(UNCHARACTERIZED
PROTEIN MJ0100)		 3kh5 PROTEIN MJ1225
(Methanocaldococc
us
jannaschii) 		6 / 11 ILE A  51
THR A  53
ASP A  56
VAL A  94
ASN A 114
PRO A 119
 ADP  A 283 ( 4.2A)
ADP  A 283 (-2.7A)
ADP  A 283 (-2.8A)
ADP  A 283 (-3.7A)
ADP  A 284 ( 4.9A)
None
 0.47A 3kpcA-3kh5A:
12.7		 3kpcA-3kh5A:
24.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3KPC_A_SAMA1000_0
(UNCHARACTERIZED
PROTEIN MJ0100)		 3kh5 PROTEIN MJ1225
(Methanocaldococc
us
jannaschii) 		6 / 11 ILE A  51
THR A  53
ASP A  56
VAL A  94
ILE A  95
PRO A 119
 ADP  A 283 ( 4.2A)
ADP  A 283 (-2.7A)
ADP  A 283 (-2.8A)
ADP  A 283 (-3.7A)
ADP  A 283 (-3.8A)
None
 0.52A 3kpcA-3kh5A:
12.7		 3kpcA-3kh5A:
24.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3KPC_A_SAMA1000_0
(UNCHARACTERIZED
PROTEIN MJ0100)		 3kh5 PROTEIN MJ1225
(Methanocaldococc
us
jannaschii) 		7 / 11 ILE A 193
THR A 195
ASP A 198
VAL A 233
ILE A 234
ILE A 254
PRO A 258
 AMP  A 282 ( 4.3A)
AMP  A 282 (-3.1A)
AMP  A 282 (-3.1A)
AMP  A 282 (-3.8A)
AMP  A 282 (-3.9A)
AMP  A 282 (-4.1A)
None
 0.55A 3kpcA-3kh5A:
12.7		 3kpcA-3kh5A:
24.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3KPC_A_SAMA1000_0
(UNCHARACTERIZED
PROTEIN MJ0100)		 3kh5 PROTEIN MJ1225
(Methanocaldococc
us
jannaschii) 		5 / 11 ILE A 269
THR A 271
ASP A 274
THR A 155
ASN A 114
 ADP  A 284 ( 4.3A)
ADP  A 284 (-3.4A)
ADP  A 284 (-2.8A)
ADP  A 284 (-3.2A)
ADP  A 284 ( 4.9A)
 1.17A 3kpcA-3kh5A:
12.7		 3kpcA-3kh5A:
24.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3KPC_A_SAMA1000_0
(UNCHARACTERIZED
PROTEIN MJ0100)		 3kh5 PROTEIN MJ1225
(Methanocaldococc
us
jannaschii) 		7 / 11 ILE A 269
THR A 271
ASP A 274
THR A 155
VAL A 158
ILE A 159
PRO A 183
 ADP  A 284 ( 4.3A)
ADP  A 284 (-3.4A)
ADP  A 284 (-2.8A)
ADP  A 284 (-3.2A)
ADP  A 284 (-3.9A)
ADP  A 284 (-4.2A)
None
 0.29A 3kpcA-3kh5A:
12.7		 3kpcA-3kh5A:
24.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3KPD_B_SAMB1000_0
(UNCHARACTERIZED
PROTEIN MJ0100)		 3kh5 PROTEIN MJ1225
(Methanocaldococc
us
jannaschii) 		5 / 12 ILE A  51
LYS A  66
VAL A  94
ILE A  95
PRO A 119
 ADP  A 283 ( 4.2A)
ADP  A 283 ( 4.4A)
ADP  A 283 (-3.7A)
ADP  A 283 (-3.8A)
None
 1.15A 3kpdB-3kh5A:
12.7		 3kpdB-3kh5A:
21.71
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.
3KPD_B_SAMB1000_0
(UNCHARACTERIZED
PROTEIN MJ0100)		 3kh5 PROTEIN MJ1225
(Methanocaldococc
us
jannaschii) 		7 / 12 ILE A  51
THR A  53
ASP A  56
VAL A  94
ILE A  95
ASN A 114
PRO A 119
 ADP  A 283 ( 4.2A)
ADP  A 283 (-2.7A)
ADP  A 283 (-2.8A)
ADP  A 283 (-3.7A)
ADP  A 283 (-3.8A)
ADP  A 284 ( 4.9A)
None
 0.58A 3kpdB-3kh5A:
12.7		 3kpdB-3kh5A:
21.71
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.
3KPD_B_SAMB1000_0
(UNCHARACTERIZED
PROTEIN MJ0100)		 3kh5 PROTEIN MJ1225
(Methanocaldococc
us
jannaschii) 		7 / 12 ILE A 193
THR A 195
ASP A 198
VAL A 233
ILE A 234
ILE A 254
PRO A 258
 AMP  A 282 ( 4.3A)
AMP  A 282 (-3.1A)
AMP  A 282 (-3.1A)
AMP  A 282 (-3.8A)
AMP  A 282 (-3.9A)
AMP  A 282 (-4.1A)
None
 0.46A 3kpdB-3kh5A:
12.7		 3kpdB-3kh5A:
21.71
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.
3KPD_B_SAMB1000_0
(UNCHARACTERIZED
PROTEIN MJ0100)		 3kh5 PROTEIN MJ1225
(Methanocaldococc
us
jannaschii) 		7 / 12 ILE A 193
THR A 195
LYS A 201
VAL A 233
ILE A 234
ILE A 254
PRO A 258
 AMP  A 282 ( 4.3A)
AMP  A 282 (-3.1A)
AMP  A 282 ( 3.7A)
AMP  A 282 (-3.8A)
AMP  A 282 (-3.9A)
AMP  A 282 (-4.1A)
None
 0.82A 3kpdB-3kh5A:
12.7		 3kpdB-3kh5A:
21.71
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.
3KPD_B_SAMB1000_0
(UNCHARACTERIZED
PROTEIN MJ0100)		 3kh5 PROTEIN MJ1225
(Methanocaldococc
us
jannaschii) 		8 / 12 ILE A 269
THR A 271
ASP A 274
LYS A 277
THR A 155
VAL A 158
ILE A 159
PRO A 183
 ADP  A 284 ( 4.3A)
ADP  A 284 (-3.4A)
ADP  A 284 (-2.8A)
ADP  A 284 (-3.5A)
ADP  A 284 (-3.2A)
ADP  A 284 (-3.9A)
ADP  A 284 (-4.2A)
None
 0.43A 3kpdB-3kh5A:
12.7		 3kpdB-3kh5A:
21.71
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.
3KPD_B_SAMB1000_0
(UNCHARACTERIZED
PROTEIN MJ0100)		 3kh5 PROTEIN MJ1225
(Methanocaldococc
us
jannaschii) 		5 / 12 ILE A 269
THR A 271
ASP A 274
THR A 155
ASN A 114
 ADP  A 284 ( 4.3A)
ADP  A 284 (-3.4A)
ADP  A 284 (-2.8A)
ADP  A 284 (-3.2A)
ADP  A 284 ( 4.9A)
 1.20A 3kpdB-3kh5A:
12.7		 3kpdB-3kh5A:
21.71
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.
3KPD_C_SAMC1000_1
(UNCHARACTERIZED
PROTEIN MJ0100)		 3kh5 PROTEIN MJ1225
(Methanocaldococc
us
jannaschii) 		6 / 12 ILE A  51
THR A  53
ASP A  56
VAL A  94
ASN A 114
PRO A 119
 ADP  A 283 ( 4.2A)
ADP  A 283 (-2.7A)
ADP  A 283 (-2.8A)
ADP  A 283 (-3.7A)
ADP  A 284 ( 4.9A)
None
 0.56A 3kpdC-3kh5A:
12.6		 3kpdC-3kh5A:
21.71
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.
3KPD_C_SAMC1000_1
(UNCHARACTERIZED
PROTEIN MJ0100)		 3kh5 PROTEIN MJ1225
(Methanocaldococc
us
jannaschii) 		6 / 12 ILE A  51
THR A  53
ASP A  56
VAL A  94
ILE A  95
PRO A 119
 ADP  A 283 ( 4.2A)
ADP  A 283 (-2.7A)
ADP  A 283 (-2.8A)
ADP  A 283 (-3.7A)
ADP  A 283 (-3.8A)
None
 0.51A 3kpdC-3kh5A:
12.6		 3kpdC-3kh5A:
21.71
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.
3KPD_C_SAMC1000_1
(UNCHARACTERIZED
PROTEIN MJ0100)		 3kh5 PROTEIN MJ1225
(Methanocaldococc
us
jannaschii) 		7 / 12 ILE A 193
THR A 195
ASP A 198
VAL A 233
ILE A 234
ILE A 254
PRO A 258
 AMP  A 282 ( 4.3A)
AMP  A 282 (-3.1A)
AMP  A 282 (-3.1A)
AMP  A 282 (-3.8A)
AMP  A 282 (-3.9A)
AMP  A 282 (-4.1A)
None
 0.59A 3kpdC-3kh5A:
12.6		 3kpdC-3kh5A:
21.71
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.
3KPD_C_SAMC1000_1
(UNCHARACTERIZED
PROTEIN MJ0100)		 3kh5 PROTEIN MJ1225
(Methanocaldococc
us
jannaschii) 		7 / 12 ILE A 269
THR A 271
ASP A 274
THR A 155
VAL A 158
ILE A 159
PRO A 183
 ADP  A 284 ( 4.3A)
ADP  A 284 (-3.4A)
ADP  A 284 (-2.8A)
ADP  A 284 (-3.2A)
ADP  A 284 (-3.9A)
ADP  A 284 (-4.2A)
None
 0.44A 3kpdC-3kh5A:
12.6		 3kpdC-3kh5A:
21.71
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.
4AZS_A_SAMA1475_1
(METHYLTRANSFERASE
WBDD)		 3kh5 PROTEIN MJ1225
(Methanocaldococc
us
jannaschii) 		3 / 3 ARG A 181
ASP A 135
GLN A  10
 ADP  A 284 ( 3.5A)
ADP  A 281 (-2.6A)
ADP  A 281 (-2.9A)
 0.63A 4azsA-3kh5A:
undetectable		 4azsA-3kh5A:
17.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4GKH_K_KANK301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 3kh5 PROTEIN MJ1225
(Methanocaldococc
us
jannaschii) 		4 / 8 ASP A 123
ASN A 100
ASP A 102
GLU A 105
 None
 1.09A 4gkhC-3kh5A:
undetectable
4gkhK-3kh5A:
undetectable		 4gkhC-3kh5A:
21.57
4gkhK-3kh5A:
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.
4GKI_G_KANG301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 3kh5 PROTEIN MJ1225
(Methanocaldococc
us
jannaschii) 		4 / 8 ASP A 123
ASN A 100
ASP A 102
GLU A 105
 None
 1.10A 4gkiE-3kh5A:
undetectable
4gkiG-3kh5A:
undetectable		 4gkiE-3kh5A:
21.57
4gkiG-3kh5A:
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.
4HIV_D_DVAD2_0
(ACTINOMYCIN D)		 3kh5 PROTEIN MJ1225
(Methanocaldococc
us
jannaschii) 		3 / 3 THR A  21
PRO A  19
THR A  20
 None
 0.85A 4hivD-3kh5A:
undetectable		 4hivD-3kh5A:
3.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4OLT_A_GCSA302_1
(CHITOSANASE)		 3kh5 PROTEIN MJ1225
(Methanocaldococc
us
jannaschii) 		4 / 5 ARG A 181
THR A 195
THR A 197
ASP A 198
 ADP  A 284 ( 3.5A)
AMP  A 282 (-3.1A)
AMP  A 282 (-3.9A)
AMP  A 282 (-3.1A)
 1.49A 4oltA-3kh5A:
undetectable		 4oltA-3kh5A:
19.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4PCU_A_SAMA603_0
(CYSTATHIONINE
BETA-SYNTHASE)		 3kh5 PROTEIN MJ1225
(Methanocaldococc
us
jannaschii) 		4 / 7 PHE A 179
PRO A 183
THR A 271
ASP A 274
 ADP  A 284 (-3.4A)
None
ADP  A 284 (-3.4A)
ADP  A 284 (-2.8A)
 0.82A 4pcuA-3kh5A:
10.4		 4pcuA-3kh5A:
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.
6FGD_A_ACTA819_0
(GEPHYRIN)		 3kh5 PROTEIN MJ1225
(Methanocaldococc
us
jannaschii) 		3 / 3 ARG A 224
GLY A 164
GLU A 165
 None
SO4  A 285 (-2.7A)
None
 0.61A 6fgdA-3kh5A:
undetectable		 6fgdA-3kh5A:
21.51