SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4y0a'

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.
1E7B_A_HLTA4002_1
(SERUM ALBUMIN)		 4y0a SHIKIMATE KINASE
(Acinetobacter
baumannii) 		4 / 4 ARG A 173
ALA A 176
ALA A  39
GLU A  40
 None
 1.07A 1e7bA-4y0aA:
undetectable		 1e7bA-4y0aA:
15.25
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.
1E7B_B_HLTB4002_1
(SERUM ALBUMIN)		 4y0a SHIKIMATE KINASE
(Acinetobacter
baumannii) 		4 / 4 ARG A 173
ALA A 176
ALA A  39
GLU A  40
 None
 1.10A 1e7bB-4y0aA:
undetectable		 1e7bB-4y0aA:
15.25
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.
1G50_B_ESTB1600_1
(ESTROGEN RECEPTOR)		 4y0a SHIKIMATE KINASE
(Acinetobacter
baumannii) 		5 / 12 LEU A  23
LEU A  90
ILE A 113
GLY A 112
LEU A 108
 None
 0.97A 1g50B-4y0aA:
undetectable		 1g50B-4y0aA:
22.53
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.
1G50_C_ESTC2600_1
(ESTROGEN RECEPTOR)		 4y0a SHIKIMATE KINASE
(Acinetobacter
baumannii) 		5 / 11 LEU A  23
LEU A  90
ILE A 113
GLY A 112
LEU A 108
 None
 0.97A 1g50C-4y0aA:
undetectable		 1g50C-4y0aA:
22.53
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.
1KVL_A_CLSA371_1
(BETA-LACTAMASE)		 4y0a SHIKIMATE KINASE
(Acinetobacter
baumannii) 		5 / 10 GLY A  96
LEU A 156
TYR A 157
THR A  94
GLY A  95
 SKM  A 201 (-3.1A)
None
None
None
SKM  A 201 ( 2.8A)
 1.31A 1kvlA-4y0aA:
undetectable		 1kvlA-4y0aA:
18.72
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.
2HC4_A_VDXA525_2
(VITAMIN D RECEPTOR)		 4y0a SHIKIMATE KINASE
(Acinetobacter
baumannii) 		4 / 7 LEU A 146
LEU A 149
ILE A  99
ARG A 105
 None
 1.24A 2hc4A-4y0aA:
undetectable		 2hc4A-4y0aA:
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.
2OUZ_A_C3DA999_0
(ESTROGEN RECEPTOR)		 4y0a SHIKIMATE KINASE
(Acinetobacter
baumannii) 		5 / 12 LEU A  23
THR A  94
LEU A  90
ILE A 113
GLY A 112
 None
 0.97A 2ouzA-4y0aA:
undetectable		 2ouzA-4y0aA:
25.21
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.
3Q95_A_ESLA700_1
(ESTROGEN RECEPTOR)		 4y0a SHIKIMATE KINASE
(Acinetobacter
baumannii) 		5 / 12 LEU A  23
LEU A  90
ILE A 113
GLY A 112
LEU A 108
 None
 0.99A 3q95A-4y0aA:
undetectable		 3q95A-4y0aA:
24.79
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.
3Q95_B_ESLB700_1
(ESTROGEN RECEPTOR)		 4y0a SHIKIMATE KINASE
(Acinetobacter
baumannii) 		5 / 12 LEU A  23
LEU A  90
ILE A 113
GLY A 112
LEU A 108
 None
 0.99A 3q95B-4y0aA:
undetectable		 3q95B-4y0aA:
24.79
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.
4TXN_A_URFA302_1
(URIDINE
PHOSPHORYLASE)		 4y0a SHIKIMATE KINASE
(Acinetobacter
baumannii) 		4 / 7 THR A  94
GLY A  96
ALA A  98
ILE A  99
 None
SKM  A 201 (-3.1A)
None
None
 0.90A 4txnA-4y0aA:
undetectable		 4txnA-4y0aA:
21.80
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.
4TXN_B_URFB302_1
(URIDINE
PHOSPHORYLASE)		 4y0a SHIKIMATE KINASE
(Acinetobacter
baumannii) 		4 / 7 THR A  94
GLY A  96
ALA A  98
ILE A  99
 None
SKM  A 201 (-3.1A)
None
None
 0.89A 4txnB-4y0aA:
undetectable		 4txnB-4y0aA:
21.80
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.
4TXN_C_URFC302_1
(URIDINE
PHOSPHORYLASE)		 4y0a SHIKIMATE KINASE
(Acinetobacter
baumannii) 		4 / 7 THR A  94
GLY A  96
ALA A  98
ILE A  99
 None
SKM  A 201 (-3.1A)
None
None
 0.88A 4txnC-4y0aA:
undetectable		 4txnC-4y0aA:
21.80
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.
4TXN_D_URFD302_1
(URIDINE
PHOSPHORYLASE)		 4y0a SHIKIMATE KINASE
(Acinetobacter
baumannii) 		4 / 7 THR A  94
GLY A  96
ALA A  98
ILE A  99
 None
SKM  A 201 (-3.1A)
None
None
 0.89A 4txnD-4y0aA:
undetectable		 4txnD-4y0aA:
21.80
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.
4URN_A_NOVA2000_1
(DNA TOPOISOMERASE
IV, B SUBUNIT)		 4y0a SHIKIMATE KINASE
(Acinetobacter
baumannii) 		5 / 11 SER A  49
GLU A  52
ASP A  48
ARG A  55
ILE A  64
 None
 1.29A 4urnA-4y0aA:
undetectable		 4urnA-4y0aA:
20.63
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.
4URN_C_NOVC2000_1
(DNA TOPOISOMERASE
IV, B SUBUNIT)		 4y0a SHIKIMATE KINASE
(Acinetobacter
baumannii) 		5 / 11 SER A  49
GLU A  52
ASP A  48
ARG A  55
ILE A  64
 None
 1.32A 4urnC-4y0aA:
undetectable		 4urnC-4y0aA:
20.63
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.
4ZVM_A_DM2A303_1
(RIBOSYLDIHYDRONICOTI
NAMIDE DEHYDROGENASE
[QUINONE])		 4y0a SHIKIMATE KINASE
(Acinetobacter
baumannii) 		5 / 12 GLY A  96
GLY A  95
THR A  94
ILE A  99
PHE A  65
 SKM  A 201 (-3.1A)
SKM  A 201 ( 2.8A)
None
None
SKM  A 201 ( 4.6A)
 1.06A 4zvmA-4y0aA:
2.8
4zvmB-4y0aA:
2.4		 4zvmA-4y0aA:
19.15
4zvmB-4y0aA:
19.15
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.
5JWA_H_ACTH614_0
(NADH DEHYDROGENASE,
PUTATIVE)		 4y0a SHIKIMATE KINASE
(Acinetobacter
baumannii) 		4 / 6 ILE A  99
VAL A 114
TYR A 116
VAL A  24
 None
 0.95A 5jwaH-4y0aA:
undetectable		 5jwaH-4y0aA:
14.78
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.
5KPC_B_SAMB401_0
(PAVINE
N-METHYLTRANSFERASE)		 4y0a SHIKIMATE KINASE
(Acinetobacter
baumannii) 		5 / 12 SER A  49
GLY A  25
GLY A  96
THR A 167
ALA A  93
 None
None
SKM  A 201 (-3.1A)
None
None
 1.06A 5kpcB-4y0aA:
undetectable		 5kpcB-4y0aA:
17.24
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.
5Y9Y_A_ACTA412_0
(UNCHARACTERIZED
PROTEIN KDOO)		 4y0a SHIKIMATE KINASE
(Acinetobacter
baumannii) 		3 / 3 ARG A 153
PHE A  65
ARG A  74
 SKM  A 201 (-2.8A)
SKM  A 201 ( 4.6A)
SKM  A 201 (-3.0A)
 0.98A 5y9yA-4y0aA:
undetectable		 5y9yA-4y0aA:
21.82
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.
6DWN_D_AQ4D602_0
(CYTOCHROME P450 1A1)		 4y0a SHIKIMATE KINASE
(Acinetobacter
baumannii) 		5 / 12 ILE A  61
SER A  49
PHE A  73
GLY A  97
ALA A  98
 SKM  A 201 ( 4.0A)
None
SKM  A 201 (-3.5A)
SKM  A 201 (-3.2A)
None
 1.05A 6dwnD-4y0aA:
undetectable		 6dwnD-4y0aA:
21.29