SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3qit'

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.
1ERR_A_RALA600_2
(ESTROGEN RECEPTOR)		 3qit POLYKETIDE SYNTHASE
(Moorea
producens) 		4 / 6 LEU A  79
HIS A  61
LEU A  96
LEU A 120
 None
 0.70A 1errA-3qitA:
undetectable		 1errA-3qitA:
22.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1KIA_D_SAMD3293_0
(GLYCINE
N-METHYLTRANSFERASE)		 3qit POLYKETIDE SYNTHASE
(Moorea
producens) 		5 / 12 ASP A  57
ALA A 103
SER A 100
HIS A 269
LEU A 276
 None
 1.23A 1kiaD-3qitA:
undetectable		 1kiaD-3qitA:
21.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ZUC_A_T98A201_1
(PROGESTERONE
RECEPTOR)		 3qit POLYKETIDE SYNTHASE
(Moorea
producens) 		5 / 10 LEU A 122
GLN A 219
LEU A  79
LEU A  96
THR A 231
 None
 1.40A 1zucA-3qitA:
undetectable		 1zucA-3qitA:
25.33
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.
2AZX_A_TRPA602_0
(TRYPTOPHANYL-TRNA
SYNTHETASE)		 3qit POLYKETIDE SYNTHASE
(Moorea
producens) 		4 / 8 ILE A 270
GLU A  34
LEU A 182
ILE A 181
 None
 0.90A 2azxA-3qitA:
undetectable		 2azxA-3qitA:
18.50
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.
2OAX_F_SNLF6001_2
(MINERALOCORTICOID
RECEPTOR)		 3qit POLYKETIDE SYNTHASE
(Moorea
producens) 		4 / 5 LEU A 233
LEU A 122
LEU A 105
MET A 254
 None
 1.10A 2oaxF-3qitA:
undetectable		 2oaxF-3qitA:
21.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2QD2_A_CHDA426_0
(FERROCHELATASE)		 3qit POLYKETIDE SYNTHASE
(Moorea
producens) 		4 / 4 LEU A  76
PRO A 214
LEU A  79
ARG A 113
 None
 1.34A 2qd2A-3qitA:
3.4		 2qd2A-3qitA:
18.96
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.
3HCO_A_CHDA3_0
(FERROCHELATASE,
MITOCHONDRIAL)		 3qit POLYKETIDE SYNTHASE
(Moorea
producens) 		4 / 4 LEU A  76
PRO A 214
LEU A  79
ARG A 113
 None
 1.28A 3hcoA-3qitA:
4.0		 3hcoA-3qitA:
18.96
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.
3HZN_G_ACTG225_0
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)		 3qit POLYKETIDE SYNTHASE
(Moorea
producens) 		3 / 3 PRO A 126
LEU A 127
GLN A 250
 None
 0.70A 3hznG-3qitA:
undetectable
3hznH-3qitA:
undetectable		 3hznG-3qitA:
19.66
3hznH-3qitA:
19.66
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.
5IKR_A_ID8A601_2
(PROSTAGLANDIN G/H
SYNTHASE 2)		 3qit POLYKETIDE SYNTHASE
(Moorea
producens) 		3 / 3 VAL A  85
LEU A 213
MET A 104
 None
 0.89A 5ikrA-3qitA:
undetectable		 5ikrA-3qitA:
17.64
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.
5ND7_B_TA1B601_2
(TUBULIN BETA-2B
CHAIN)		 3qit POLYKETIDE SYNTHASE
(Moorea
producens) 		3 / 3 THR A 204
PRO A 155
ARG A 195
 None
 0.82A 5nd7B-3qitA:
4.0		 5nd7B-3qitA:
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.
5NKN_A_LOCA201_2
(NEUTROPHIL
GELATINASE-ASSOCIATE
D LIPOCALIN)		 3qit POLYKETIDE SYNTHASE
(Moorea
producens) 		3 / 3 VAL A 112
LYS A 225
MET A 254
 None
 1.06A 5nknA-3qitA:
undetectable		 5nknA-3qitA:
14.64
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.
5TE8_B_08JB602_1
(CYTOCHROME P450 3A4)		 3qit POLYKETIDE SYNTHASE
(Moorea
producens) 		4 / 8 ALA A  47
ILE A 280
ALA A 277
LEU A 281
 None
 0.83A 5te8B-3qitA:
undetectable		 5te8B-3qitA:
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.
5TE8_B_08JB602_1
(CYTOCHROME P450 3A4)		 3qit POLYKETIDE SYNTHASE
(Moorea
producens) 		4 / 8 ALA A 103
ILE A 109
ALA A 110
LEU A  96
 None
 0.84A 5te8B-3qitA:
undetectable		 5te8B-3qitA:
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.
5VEU_H_RITH602_1
(CYTOCHROME P450 3A5)		 3qit POLYKETIDE SYNTHASE
(Moorea
producens) 		5 / 12 SER A  64
GLY A  98
ILE A  13
THR A  77
GLY A 102
 None
 1.02A 5veuH-3qitA:
undetectable		 5veuH-3qitA:
21.37
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.
5XXI_A_LSNA503_1
(CYTOCHROME P450 2C9)		 3qit POLYKETIDE SYNTHASE
(Moorea
producens) 		5 / 12 LEU A 241
ASN A 242
LEU A 105
THR A 107
LEU A 224
 None
 1.25A 5xxiA-3qitA:
undetectable		 5xxiA-3qitA:
21.11