SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3k31'

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.
1HSG_B_MK1B902_1
(HIV-1 PROTEASE)		 3k31 ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
(Anaplasma
phagocytophilum) 		5 / 10 LEU A  40
VAL A  92
GLY A 228
VAL A  17
ILE A  14
 None
 0.88A 1hsgA-3k31A:
undetectable		 1hsgA-3k31A:
17.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1LQT_A_ACTA1872_0
(FPRA)		 3k31 ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
(Anaplasma
phagocytophilum) 		4 / 5 SER A  22
ASN A  19
ALA A  18
ASP A  20
 None
None
NAD  A 300 ( 4.1A)
None
 1.15A 1lqtA-3k31A:
4.0
1lqtB-3k31A:
5.1		 1lqtA-3k31A:
22.57
1lqtB-3k31A:
22.57
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.
1LQU_A_ACTA1429_0
(FPRA)		 3k31 ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
(Anaplasma
phagocytophilum) 		4 / 5 SER A  22
ASN A  19
ALA A  18
ASP A  20
 None
None
NAD  A 300 ( 4.1A)
None
 1.15A 1lquA-3k31A:
5.2
1lquB-3k31A:
3.6		 1lquA-3k31A:
22.57
1lquB-3k31A:
22.57
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.
1QKU_A_ESTA600_1
(ESTRADIOL RECEPTOR)		 3k31 ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
(Anaplasma
phagocytophilum) 		5 / 10 ALA A  71
GLU A  72
MET A  77
ILE A  15
HIS A  93
 EDO  A 400 (-3.6A)
None
None
None
None
 0.96A 1qkuA-3k31A:
undetectable		 1qkuA-3k31A:
19.87
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.
1QKU_B_ESTB600_1
(ESTRADIOL RECEPTOR)		 3k31 ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
(Anaplasma
phagocytophilum) 		5 / 10 ALA A  71
GLU A  72
MET A  77
ILE A  15
HIS A  93
 EDO  A 400 (-3.6A)
None
None
None
None
 0.97A 1qkuB-3k31A:
undetectable		 1qkuB-3k31A:
19.87
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.
1QKU_C_ESTC600_1
(ESTRADIOL RECEPTOR)		 3k31 ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
(Anaplasma
phagocytophilum) 		5 / 10 ALA A  71
GLU A  72
MET A  77
ILE A  15
HIS A  93
 EDO  A 400 (-3.6A)
None
None
None
None
 0.97A 1qkuC-3k31A:
undetectable		 1qkuC-3k31A:
19.87
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.
1RX3_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 3k31 ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
(Anaplasma
phagocytophilum) 		5 / 12 ILE A  14
ALA A  39
MET A  77
LEU A  88
ILE A 129
 None
 1.14A 1rx3A-3k31A:
undetectable		 1rx3A-3k31A:
18.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1WRL_D_TFPD207_1
(TROPONIN C, SLOW
SKELETAL AND CARDIAC
MUSCLES)		 3k31 ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
(Anaplasma
phagocytophilum) 		4 / 8 SER A 171
PHE A 115
MET A 119
SER A 122
 None
 0.90A 1wrlC-3k31A:
undetectable
1wrlD-3k31A:
undetectable		 1wrlC-3k31A:
16.04
1wrlD-3k31A:
16.04
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.
2A1O_A_CAMA1422_0
(CYTOCHROME P450-CAM)		 3k31 ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
(Anaplasma
phagocytophilum) 		4 / 8 LEU A 224
VAL A 227
GLY A 228
VAL A  92
 None
 0.68A 2a1oA-3k31A:
undetectable		 2a1oA-3k31A:
22.30
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.
2O4P_A_TPVA300_2
(PROTEASE)		 3k31 ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
(Anaplasma
phagocytophilum) 		5 / 9 LEU A  40
VAL A  92
GLY A 228
VAL A  17
ILE A  14
 None
 1.01A 2o4pB-3k31A:
undetectable		 2o4pB-3k31A:
16.89
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.
2OPX_A_DXCA1002_0
(ALDEHYDE
DEHYDROGENASE A)		 3k31 ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
(Anaplasma
phagocytophilum) 		3 / 3 GLY A 239
ARG A 185
TYR A 233
 None
 0.70A 2opxA-3k31A:
4.2		 2opxA-3k31A:
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.
2ZZA_A_FOLA164_0
(DIHYDROFOLATE
REDUCTASE)		 3k31 ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
(Anaplasma
phagocytophilum) 		5 / 12 ILE A  14
ALA A  39
MET A  77
LEU A  88
ILE A 129
 None
 1.09A 2zzaA-3k31A:
undetectable		 2zzaA-3k31A:
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.
2ZZA_B_FOLB164_0
(DIHYDROFOLATE
REDUCTASE)		 3k31 ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
(Anaplasma
phagocytophilum) 		5 / 11 ILE A  14
ALA A  39
MET A  77
LEU A  88
ILE A 129
 None
 1.09A 2zzaB-3k31A:
undetectable		 2zzaB-3k31A:
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.
3E22_D_LOCD700_2
(TUBULIN BETA-2B
CHAIN)		 3k31 ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
(Anaplasma
phagocytophilum) 		5 / 11 LEU A 235
ALA A 231
ALA A  36
VAL A  38
LYS A  10
 None
 1.23A 3e22D-3k31A:
6.7		 3e22D-3k31A:
21.60
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.
3EM3_B_478B200_2
(PROTEASE)		 3k31 ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
(Anaplasma
phagocytophilum) 		5 / 10 LEU A  40
VAL A  92
GLY A 228
VAL A  17
ILE A  14
 None
 0.96A 3em3B-3k31A:
undetectable		 3em3B-3k31A:
13.95
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.
3IA4_B_MTXB164_1
(DIHYDROFOLATE
REDUCTASE)		 3k31 ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
(Anaplasma
phagocytophilum) 		5 / 12 ILE A  14
ALA A  39
MET A  77
LEU A  88
ILE A 129
 None
 1.16A 3ia4B-3k31A:
undetectable		 3ia4B-3k31A:
20.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3IA4_D_MTXD164_1
(DIHYDROFOLATE
REDUCTASE)		 3k31 ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
(Anaplasma
phagocytophilum) 		5 / 12 ILE A  14
ALA A  39
MET A  77
LEU A  88
ILE A 129
 None
 1.10A 3ia4D-3k31A:
undetectable		 3ia4D-3k31A:
20.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3PGH_A_FLPA701_1
(CYCLOOXYGENASE-2)		 3k31 ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
(Anaplasma
phagocytophilum) 		5 / 12 VAL A  38
VAL A  51
ALA A  55
SER A  57
LEU A  58
 None
 1.09A 3pghA-3k31A:
undetectable		 3pghA-3k31A:
18.93
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.
3QL0_A_FOLA160_0
(DIHYDROFOLATE
REDUCTASE)		 3k31 ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
(Anaplasma
phagocytophilum) 		5 / 12 ILE A  14
ALA A  39
MET A  77
LEU A  88
ILE A 129
 None
 1.04A 3ql0A-3k31A:
undetectable		 3ql0A-3k31A:
16.10
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.
3QL3_A_FOLA161_0
(DIHYDROFOLATE
REDUCTASE)		 3k31 ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
(Anaplasma
phagocytophilum) 		5 / 12 ILE A  14
ALA A  39
MET A  77
LEU A  88
ILE A 129
 None
 1.09A 3ql3A-3k31A:
undetectable		 3ql3A-3k31A:
18.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4J24_D_ESTD600_1
(ESTROGEN RECEPTOR
BETA)		 3k31 ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
(Anaplasma
phagocytophilum) 		5 / 12 ALA A  71
GLU A  72
MET A  77
ILE A  15
HIS A  93
 EDO  A 400 (-3.6A)
None
None
None
None
 1.05A 4j24D-3k31A:
undetectable		 4j24D-3k31A:
24.76
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.
4P3R_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 3k31 ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
(Anaplasma
phagocytophilum) 		5 / 12 ILE A  14
ALA A  39
MET A  77
LEU A  88
ILE A 129
 None
 1.05A 4p3rA-3k31A:
undetectable		 4p3rA-3k31A:
16.10
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.
4RGC_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 3k31 ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
(Anaplasma
phagocytophilum) 		5 / 12 ILE A  14
ALA A  39
MET A  77
LEU A  88
ILE A 129
 None
 1.16A 4rgcA-3k31A:
undetectable		 4rgcA-3k31A:
16.10
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.
5E5J_A_017A201_3
(PROTEASE)		 3k31 ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
(Anaplasma
phagocytophilum) 		3 / 3 ASP A 226
VAL A 194
LEU A  23
 None
 0.43A 5e5jB-3k31A:
undetectable		 5e5jB-3k31A:
19.22
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.
5IKT_A_TLFA601_0
(PROSTAGLANDIN G/H
SYNTHASE 2)		 3k31 ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
(Anaplasma
phagocytophilum) 		5 / 12 VAL A  92
VAL A 227
GLY A 229
ALA A 231
LEU A 235
 None
 1.04A 5iktA-3k31A:
undetectable		 5iktA-3k31A:
18.15
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.
5TUD_A_ERMA2001_1
(5-HYDROXYTRYPTAMINE
RECEPTOR 2B,SOLUBLE
CYTOCHROME B562
CHIMERA)		 3k31 ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
(Anaplasma
phagocytophilum) 		5 / 12 LEU A 234
ALA A 133
PHE A 126
LEU A 168
VAL A 172
 None
 1.17A 5tudA-3k31A:
undetectable		 5tudA-3k31A:
21.95
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.
5X23_A_LSNA502_1
(CYTOCHROME P450 2C9)		 3k31 ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
(Anaplasma
phagocytophilum) 		5 / 12 ALA A  36
GLY A 229
ALA A 230
LEU A 146
LEU A 144
 None
 1.09A 5x23A-3k31A:
undetectable		 5x23A-3k31A:
21.50
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.
5XXI_A_LSNA501_1
(CYTOCHROME P450 2C9)		 3k31 ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
(Anaplasma
phagocytophilum) 		5 / 12 ALA A  36
GLY A 229
ALA A 230
LEU A 146
LEU A 144
 None
 1.09A 5xxiA-3k31A:
undetectable		 5xxiA-3k31A:
21.51
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.
5Z6F_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 3k31 ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
(Anaplasma
phagocytophilum) 		5 / 12 ILE A  14
ALA A  39
MET A  77
LEU A  88
ILE A 129
 None
 1.04A 5z6fA-3k31A:
undetectable		 5z6fA-3k31A:
16.10
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.
6CBZ_B_ESTB602_1
(ESTROGEN RECEPTOR)		 3k31 ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
(Anaplasma
phagocytophilum) 		5 / 10 ALA A  71
GLU A  72
MET A  77
ILE A  15
HIS A  93
 EDO  A 400 (-3.6A)
None
None
None
None
 1.10A 6cbzB-3k31A:
undetectable		 6cbzB-3k31A:
17.62