SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3klj'

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.
1FM4_A_DXCA1002_0
(MAJOR POLLEN
ALLERGEN BET V 1-L)		 3klj NAD(FAD)-DEPENDENT
DEHYDROGENASE,
NIRB-FAMILY
(N-TERMINAL DOMAIN)
(Clostridium
acetobutylicum) 		5 / 12 VAL A 350
ILE A 300
ILE A 271
ASN A 272
TYR A  41
 None
None
FAD  A 401 (-4.3A)
None
None
 1.28A 1fm4A-3kljA:
undetectable		 1fm4A-3kljA:
19.78
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.
1HWI_A_115A2_2
(HMG-COA REDUCTASE)		 3klj NAD(FAD)-DEPENDENT
DEHYDROGENASE,
NIRB-FAMILY
(N-TERMINAL DOMAIN)
(Clostridium
acetobutylicum) 		4 / 8 ASN A 377
LEU A 379
ALA A 359
LEU A 356
 None
 0.87A 1hwiB-3kljA:
undetectable		 1hwiB-3kljA:
23.22
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.
1HWI_C_115C4_2
(HMG-COA REDUCTASE)		 3klj NAD(FAD)-DEPENDENT
DEHYDROGENASE,
NIRB-FAMILY
(N-TERMINAL DOMAIN)
(Clostridium
acetobutylicum) 		4 / 8 ASN A 377
LEU A 379
ALA A 359
LEU A 356
 None
 0.86A 1hwiD-3kljA:
undetectable		 1hwiD-3kljA:
23.22
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.
1HWI_D_115D3_1
(HMG-COA REDUCTASE)		 3klj NAD(FAD)-DEPENDENT
DEHYDROGENASE,
NIRB-FAMILY
(N-TERMINAL DOMAIN)
(Clostridium
acetobutylicum) 		4 / 8 ASN A 377
LEU A 379
ALA A 359
LEU A 356
 None
 0.86A 1hwiC-3kljA:
undetectable		 1hwiC-3kljA:
23.22
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.
1JG3_A_ADNA500_1
(PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE)		 3klj NAD(FAD)-DEPENDENT
DEHYDROGENASE,
NIRB-FAMILY
(N-TERMINAL DOMAIN)
(Clostridium
acetobutylicum) 		5 / 11 GLY A  15
GLY A  10
ILE A 104
LEU A   9
GLY A 278
 None
FAD  A 401 (-3.2A)
None
FAD  A 401 (-4.7A)
None
 0.92A 1jg3A-3kljA:
undetectable		 1jg3A-3kljA:
21.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1JG3_B_ADNB550_1
(PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE)		 3klj NAD(FAD)-DEPENDENT
DEHYDROGENASE,
NIRB-FAMILY
(N-TERMINAL DOMAIN)
(Clostridium
acetobutylicum) 		5 / 11 GLY A  15
GLY A  10
ILE A 104
LEU A   9
GLY A 278
 None
FAD  A 401 (-3.2A)
None
FAD  A 401 (-4.7A)
None
 0.92A 1jg3B-3kljA:
2.6		 1jg3B-3kljA:
21.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1JZS_A_MRCA1301_1
(ISOLEUCYL-TRNA
SYNTHETASE)		 3klj NAD(FAD)-DEPENDENT
DEHYDROGENASE,
NIRB-FAMILY
(N-TERMINAL DOMAIN)
(Clostridium
acetobutylicum) 		5 / 11 GLY A 269
PRO A 268
GLY A 107
LEU A   9
ILE A   8
 FAD  A 401 (-4.3A)
None
FAD  A 401 (-3.1A)
FAD  A 401 (-4.7A)
None
 1.22A 1jzsA-3kljA:
undetectable		 1jzsA-3kljA:
19.77
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.
1KIJ_A_NOVA400_1
(DNA GYRASE SUBUNIT B)		 3klj NAD(FAD)-DEPENDENT
DEHYDROGENASE,
NIRB-FAMILY
(N-TERMINAL DOMAIN)
(Clostridium
acetobutylicum) 		5 / 12 ASP A 228
ASP A 232
ILE A 235
ILE A 241
THR A 233
 None
 1.20A 1kijA-3kljA:
undetectable		 1kijA-3kljA:
20.71
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.
1L5R_A_RBFA859_1
(GLYCOGEN
PHOSPHORYLASE, LIVER
FORM)		 3klj NAD(FAD)-DEPENDENT
DEHYDROGENASE,
NIRB-FAMILY
(N-TERMINAL DOMAIN)
(Clostridium
acetobutylicum) 		5 / 11 ASN A 267
GLU A 294
TYR A 264
ALA A 261
GLY A 258
 None
None
None
None
FAD  A 401 (-3.5A)
 1.49A 1l5rA-3kljA:
undetectable		 1l5rA-3kljA:
18.85
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.
1R9O_A_FLPA501_1
(CYTOCHROME P450 2C9)		 3klj NAD(FAD)-DEPENDENT
DEHYDROGENASE,
NIRB-FAMILY
(N-TERMINAL DOMAIN)
(Clostridium
acetobutylicum) 		5 / 12 ILE A  60
LEU A  59
MET A  31
GLY A  12
LEU A  45
 None
None
None
FAD  A 401 (-3.3A)
FAD  A 401 ( 4.9A)
 1.06A 1r9oA-3kljA:
undetectable		 1r9oA-3kljA:
21.75
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.
1W0G_A_MYTA1499_1
(CYTOCHROME P450 3A4)		 3klj NAD(FAD)-DEPENDENT
DEHYDROGENASE,
NIRB-FAMILY
(N-TERMINAL DOMAIN)
(Clostridium
acetobutylicum) 		4 / 6 SER A 304
ILE A 197
ALA A 156
ALA A  50
 None
 0.98A 1w0gA-3kljA:
undetectable		 1w0gA-3kljA:
22.97
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.
2ACL_E_REAE504_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 3klj NAD(FAD)-DEPENDENT
DEHYDROGENASE,
NIRB-FAMILY
(N-TERMINAL DOMAIN)
(Clostridium
acetobutylicum) 		6 / 11 ILE A 160
ALA A 166
ALA A 156
ASN A  46
LEU A 155
ALA A 143
 None
 1.47A 2aclE-3kljA:
undetectable		 2aclE-3kljA:
21.30
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.
2JKJ_A_CLMA1141_0
(DR HEMAGGLUTININ
STRUCTURAL SUBUNIT)		 3klj NAD(FAD)-DEPENDENT
DEHYDROGENASE,
NIRB-FAMILY
(N-TERMINAL DOMAIN)
(Clostridium
acetobutylicum) 		4 / 6 PRO A 175
GLY A 149
ILE A 145
GLY A 147
 None
 0.83A 2jkjA-3kljA:
undetectable		 2jkjA-3kljA:
17.48
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.
2JKJ_B_CLMB1141_0
(DR HEMAGGLUTININ
STRUCTURAL SUBUNIT)		 3klj NAD(FAD)-DEPENDENT
DEHYDROGENASE,
NIRB-FAMILY
(N-TERMINAL DOMAIN)
(Clostridium
acetobutylicum) 		4 / 6 PRO A 175
GLY A 149
ILE A 145
GLY A 147
 None
 0.83A 2jkjB-3kljA:
undetectable		 2jkjB-3kljA:
17.48
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.
2JKJ_C_CLMC1141_0
(DR HEMAGGLUTININ
STRUCTURAL SUBUNIT)		 3klj NAD(FAD)-DEPENDENT
DEHYDROGENASE,
NIRB-FAMILY
(N-TERMINAL DOMAIN)
(Clostridium
acetobutylicum) 		4 / 6 PRO A 175
GLY A 149
ILE A 145
GLY A 147
 None
 0.84A 2jkjC-3kljA:
undetectable		 2jkjC-3kljA:
17.48
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.
2JKJ_E_CLME1141_0
(DR HEMAGGLUTININ
STRUCTURAL SUBUNIT)		 3klj NAD(FAD)-DEPENDENT
DEHYDROGENASE,
NIRB-FAMILY
(N-TERMINAL DOMAIN)
(Clostridium
acetobutylicum) 		4 / 7 PRO A 175
GLY A 149
ILE A 145
GLY A 147
 None
 0.83A 2jkjE-3kljA:
undetectable		 2jkjE-3kljA:
17.48
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.
2JKL_A_CLMA1144_0
(DR HEMAGGLUTININ
STRUCTURAL SUBUNIT)		 3klj NAD(FAD)-DEPENDENT
DEHYDROGENASE,
NIRB-FAMILY
(N-TERMINAL DOMAIN)
(Clostridium
acetobutylicum) 		4 / 7 PRO A 175
GLY A 149
ILE A 145
GLY A 147
 None
 0.87A 2jklA-3kljA:
undetectable		 2jklA-3kljA:
17.48
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.
2JKL_D_CLMD1145_0
(DR HEMAGGLUTININ
STRUCTURAL SUBUNIT)		 3klj NAD(FAD)-DEPENDENT
DEHYDROGENASE,
NIRB-FAMILY
(N-TERMINAL DOMAIN)
(Clostridium
acetobutylicum) 		4 / 7 PRO A 175
GLY A 149
ILE A 145
GLY A 147
 None
 0.87A 2jklD-3kljA:
undetectable		 2jklD-3kljA:
17.48
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.
2JKL_F_CLMF1143_0
(DR HEMAGGLUTININ
STRUCTURAL SUBUNIT)		 3klj NAD(FAD)-DEPENDENT
DEHYDROGENASE,
NIRB-FAMILY
(N-TERMINAL DOMAIN)
(Clostridium
acetobutylicum) 		4 / 7 PRO A 175
GLY A 149
ILE A 145
GLY A 147
 None
 0.88A 2jklF-3kljA:
undetectable		 2jklF-3kljA:
17.48
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.
2NNI_A_MTKA501_2
(CYTOCHROME P450 2C8)		 3klj NAD(FAD)-DEPENDENT
DEHYDROGENASE,
NIRB-FAMILY
(N-TERMINAL DOMAIN)
(Clostridium
acetobutylicum) 		5 / 8 ILE A 254
ILE A 104
ILE A   8
VAL A 260
ALA A  14
 None
None
None
None
FAD  A 401 (-3.1A)
 1.45A 2nniA-3kljA:
undetectable		 2nniA-3kljA:
21.24
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.
2OTF_A_2TNA201_1
(PHOSPHOLIPASE A2
VRV-PL-VIIIA)		 3klj NAD(FAD)-DEPENDENT
DEHYDROGENASE,
NIRB-FAMILY
(N-TERMINAL DOMAIN)
(Clostridium
acetobutylicum) 		4 / 5 LEU A 188
ILE A 197
SER A 304
GLY A 305
 None
 1.02A 2otfA-3kljA:
undetectable		 2otfA-3kljA:
16.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2XRH_A_NIOA200_1
(PROTEIN HP0721)		 3klj NAD(FAD)-DEPENDENT
DEHYDROGENASE,
NIRB-FAMILY
(N-TERMINAL DOMAIN)
(Clostridium
acetobutylicum) 		4 / 7 GLY A 185
ILE A 199
THR A 201
LEU A 186
 None
 0.99A 2xrhA-3kljA:
undetectable		 2xrhA-3kljA:
13.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3I5U_A_SAMA401_0
(O-METHYLTRANSFERASE)		 3klj NAD(FAD)-DEPENDENT
DEHYDROGENASE,
NIRB-FAMILY
(N-TERMINAL DOMAIN)
(Clostridium
acetobutylicum) 		5 / 12 GLY A 184
GLY A 185
LEU A 192
PRO A 175
ALA A 345
 None
 1.20A 3i5uA-3kljA:
undetectable		 3i5uA-3kljA:
22.71
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.
3I5U_B_SAMB401_0
(O-METHYLTRANSFERASE)		 3klj NAD(FAD)-DEPENDENT
DEHYDROGENASE,
NIRB-FAMILY
(N-TERMINAL DOMAIN)
(Clostridium
acetobutylicum) 		5 / 12 GLY A 184
GLY A 185
LEU A 192
PRO A 175
ALA A 345
 None
 1.18A 3i5uB-3kljA:
undetectable		 3i5uB-3kljA:
22.71
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)		 3klj NAD(FAD)-DEPENDENT
DEHYDROGENASE,
NIRB-FAMILY
(N-TERMINAL DOMAIN)
(Clostridium
acetobutylicum) 		5 / 10 ILE A  82
THR A 233
ASP A 232
VAL A  89
ILE A 104
 None
 1.47A 3kpbD-3kljA:
undetectable		 3kpbD-3kljA:
18.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3NU4_B_478B401_1
(PROTEASE)		 3klj NAD(FAD)-DEPENDENT
DEHYDROGENASE,
NIRB-FAMILY
(N-TERMINAL DOMAIN)
(Clostridium
acetobutylicum) 		5 / 9 ASP A 129
ILE A 133
GLY A 152
ILE A 153
ILE A  49
 None
 1.08A 3nu4A-3kljA:
undetectable		 3nu4A-3kljA:
12.24
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.
3NUO_B_478B478_1
(PROTEASE)		 3klj NAD(FAD)-DEPENDENT
DEHYDROGENASE,
NIRB-FAMILY
(N-TERMINAL DOMAIN)
(Clostridium
acetobutylicum) 		5 / 9 ASP A 129
ILE A 218
GLY A 152
ILE A 153
ILE A  49
 None
 1.13A 3nuoA-3kljA:
undetectable		 3nuoA-3kljA:
15.30
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.
4RP8_C_ASCC501_0
(ASCORBATE-SPECIFIC
PERMEASE IIC
COMPONENT ULAA)		 3klj NAD(FAD)-DEPENDENT
DEHYDROGENASE,
NIRB-FAMILY
(N-TERMINAL DOMAIN)
(Clostridium
acetobutylicum) 		5 / 12 LEU A 102
THR A 233
ALA A  79
ILE A 230
PHE A 229
 None
None
FAD  A 401 (-3.7A)
None
FAD  A 401 (-4.4A)
 1.16A 4rp8C-3kljA:
undetectable		 4rp8C-3kljA:
21.89
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.
5JGL_A_SAMA301_1
(UBIE/COQ5 FAMILY
METHYLTRANSFERASE,
PUTATIVE)		 3klj NAD(FAD)-DEPENDENT
DEHYDROGENASE,
NIRB-FAMILY
(N-TERMINAL DOMAIN)
(Clostridium
acetobutylicum) 		3 / 3 GLY A 184
ASP A 181
ASN A 317
 None
 0.49A 5jglA-3kljA:
undetectable		 5jglA-3kljA:
21.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5TE8_B_08JB602_1
(CYTOCHROME P450 3A4)		 3klj NAD(FAD)-DEPENDENT
DEHYDROGENASE,
NIRB-FAMILY
(N-TERMINAL DOMAIN)
(Clostridium
acetobutylicum) 		4 / 8 ALA A 130
ILE A 159
ALA A 158
LEU A 155
 None
 0.76A 5te8B-3kljA:
undetectable		 5te8B-3kljA:
22.88
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.
5U4S_A_BEZA301_0
(PUTATIVE SHORT CHAIN
DEHYDROGENASE)		 3klj NAD(FAD)-DEPENDENT
DEHYDROGENASE,
NIRB-FAMILY
(N-TERMINAL DOMAIN)
(Clostridium
acetobutylicum) 		4 / 7 SER A 167
ILE A 168
MET A 208
LEU A 211
 None
 0.98A 5u4sA-3kljA:
4.6		 5u4sA-3kljA:
19.39
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.
6DJ1_B_AB1B201_0
(HIV-1 PROTEASE)		 3klj NAD(FAD)-DEPENDENT
DEHYDROGENASE,
NIRB-FAMILY
(N-TERMINAL DOMAIN)
(Clostridium
acetobutylicum) 		5 / 12 ALA A 156
GLY A 148
GLY A 149
ILE A 150
ILE A 197
 None
 0.68A 6dj1A-3kljA:
undetectable		 6dj1A-3kljA:
12.53