SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4n4k'

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.
1A4L_A_DCFA353_1
(ADENOSINE DEAMINASE)		 4n4k HYDROXYLAMINE
OXIDOREDUCTASE
(Candidatus
Kuenenia
stuttgartiensis) 		5 / 12 HIS A 305
MET A 362
ALA A 442
HIS A 443
GLU A 265
 HEM  A 613 (-3.3A)
HEM  A 613 ( 4.5A)
HEM  A 613 (-3.6A)
HEM  A 613 (-3.3A)
HEM  A 613 (-3.6A)
 1.30A 1a4lA-4n4kA:
undetectable		 1a4lA-4n4kA:
21.33
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.
1I9G_A_SAMA301_1
(HYPOTHETICAL PROTEIN
RV2118C)		 4n4k HYDROXYLAMINE
OXIDOREDUCTASE
(Candidatus
Kuenenia
stuttgartiensis) 		3 / 3 GLU A 265
HIS A 258
ASP A 262
 HEM  A 613 (-3.6A)
HEM  A 612 (-3.3A)
HOA  A 615 (-2.9A)
 0.74A 1i9gA-4n4kA:
undetectable		 1i9gA-4n4kA:
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.
1MZ9_A_VDYA1002_4
(CARTILAGE OLIGOMERIC
MATRIX PROTEIN)		 4n4k HYDROXYLAMINE
OXIDOREDUCTASE
(Candidatus
Kuenenia
stuttgartiensis) 		4 / 5 VAL A 117
CYH A 116
ALA A 161
CYH A 160
 HEM  A 608 ( 4.8A)
HEM  A 607 (-1.7A)
HEM  A 607 (-3.9A)
HEM  A 608 ( 1.8A)
 1.04A 1mz9D-4n4kA:
undetectable		 1mz9D-4n4kA:
6.26
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.
2E5D_A_NCAA1501_0
(NICOTINAMIDE
PHOSPHORIBOSYLTRANSF
ERASE)		 4n4k HYDROXYLAMINE
OXIDOREDUCTASE
(Candidatus
Kuenenia
stuttgartiensis) 		4 / 7 ASP A 399
ARG A 507
ASP A 413
TYR A 401
 None
 1.19A 2e5dA-4n4kA:
undetectable
2e5dB-4n4kA:
undetectable		 2e5dA-4n4kA:
23.37
2e5dB-4n4kA:
23.37
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.
2E5D_B_NCAB1502_0
(NICOTINAMIDE
PHOSPHORIBOSYLTRANSF
ERASE)		 4n4k HYDROXYLAMINE
OXIDOREDUCTASE
(Candidatus
Kuenenia
stuttgartiensis) 		4 / 7 ASP A 413
TYR A 401
ASP A 399
ARG A 507
 None
 1.06A 2e5dA-4n4kA:
undetectable
2e5dB-4n4kA:
undetectable		 2e5dA-4n4kA:
23.37
2e5dB-4n4kA:
23.37
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.
2J2P_B_SC2B1290_1
(FICOLIN-2)		 4n4k HYDROXYLAMINE
OXIDOREDUCTASE
(Candidatus
Kuenenia
stuttgartiensis) 		4 / 8 SER A 420
LEU A 422
LEU A 473
ASP A 390
 None
 1.09A 2j2pA-4n4kA:
undetectable
2j2pB-4n4kA:
undetectable		 2j2pA-4n4kA:
18.90
2j2pB-4n4kA:
18.90
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.
2Y4N_B_PACB503_0
(PHENYLACETATE-COENZY
ME A LIGASE)		 4n4k HYDROXYLAMINE
OXIDOREDUCTASE
(Candidatus
Kuenenia
stuttgartiensis) 		4 / 4 SER A  84
GLY A 214
GLY A 504
LYS A 506
 None
 1.48A 2y4nB-4n4kA:
undetectable		 2y4nB-4n4kA:
21.38
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.
3F8W_A_ADNA300_1
(PURINE-NUCLEOSIDE
PHOSPHORYLASE)		 4n4k HYDROXYLAMINE
OXIDOREDUCTASE
(Candidatus
Kuenenia
stuttgartiensis) 		5 / 12 GLY A 196
GLY A 194
ASN A 205
HIS A 524
VAL A 204
 HEM  A 612 (-3.3A)
None
HEC  A 610 ( 3.5A)
None
None
 1.12A 3f8wA-4n4kA:
undetectable		 3f8wA-4n4kA:
19.50
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.
3F8W_B_ADNB301_1
(PURINE-NUCLEOSIDE
PHOSPHORYLASE)		 4n4k HYDROXYLAMINE
OXIDOREDUCTASE
(Candidatus
Kuenenia
stuttgartiensis) 		5 / 12 GLY A 196
GLY A 194
ASN A 205
HIS A 524
VAL A 204
 HEM  A 612 (-3.3A)
None
HEC  A 610 ( 3.5A)
None
None
 1.10A 3f8wB-4n4kA:
undetectable		 3f8wB-4n4kA:
19.50
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.
3VQR_A_ACTA1002_0
(PUTATIVE
OXIDOREDUCTASE)		 4n4k HYDROXYLAMINE
OXIDOREDUCTASE
(Candidatus
Kuenenia
stuttgartiensis) 		4 / 6 ASP A  56
GLY A  54
ASP A  58
THR A  60
 None
 1.18A 3vqrA-4n4kA:
undetectable		 3vqrA-4n4kA:
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.
3VQR_B_ACTB1002_0
(PUTATIVE
OXIDOREDUCTASE)		 4n4k HYDROXYLAMINE
OXIDOREDUCTASE
(Candidatus
Kuenenia
stuttgartiensis) 		4 / 5 ASP A  56
GLY A  54
ASP A  58
THR A  60
 None
 1.20A 3vqrB-4n4kA:
undetectable		 3vqrB-4n4kA:
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.
4BBO_B_ACTB1114_0
(BLR5658 PROTEIN)		 4n4k HYDROXYLAMINE
OXIDOREDUCTASE
(Candidatus
Kuenenia
stuttgartiensis) 		3 / 3 TRP A  94
TRP A 101
THR A 102
 None
 1.30A 4bboB-4n4kA:
undetectable		 4bboB-4n4kA:
12.96
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.
4MJW_A_ACTA603_0
(CHOLINE OXIDASE)		 4n4k HYDROXYLAMINE
OXIDOREDUCTASE
(Candidatus
Kuenenia
stuttgartiensis) 		3 / 3 ARG A 240
HIS A 241
SER A 235
 HEM  A 608 (-3.6A)
HEM  A 608 ( 3.3A)
HEM  A 608 (-2.5A)
 0.91A 4mjwA-4n4kA:
undetectable
4mjwB-4n4kA:
undetectable		 4mjwA-4n4kA:
22.19
4mjwB-4n4kA:
22.19
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.
4MJW_B_ACTB603_0
(CHOLINE OXIDASE)		 4n4k HYDROXYLAMINE
OXIDOREDUCTASE
(Candidatus
Kuenenia
stuttgartiensis) 		3 / 3 SER A 235
ARG A 240
HIS A 241
 HEM  A 608 (-2.5A)
HEM  A 608 (-3.6A)
HEM  A 608 ( 3.3A)
 0.95A 4mjwA-4n4kA:
undetectable
4mjwB-4n4kA:
undetectable		 4mjwA-4n4kA:
22.19
4mjwB-4n4kA:
22.19
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.
4TWD_A_377A401_1
(CYS-LOOP
LIGAND-GATED ION
CHANNEL)		 4n4k HYDROXYLAMINE
OXIDOREDUCTASE
(Candidatus
Kuenenia
stuttgartiensis) 		4 / 5 GLU A 219
GLU A 218
TYR A  70
TYR A 498
 None
 0.78A 4twdA-4n4kA:
1.5
4twdE-4n4kA:
1.9		 4twdA-4n4kA:
21.08
4twdE-4n4kA:
21.08
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.
4TWD_B_377B401_1
(CYS-LOOP
LIGAND-GATED ION
CHANNEL)		 4n4k HYDROXYLAMINE
OXIDOREDUCTASE
(Candidatus
Kuenenia
stuttgartiensis) 		4 / 5 TYR A 498
GLU A 219
GLU A 218
TYR A  70
 None
 0.77A 4twdA-4n4kA:
1.5
4twdB-4n4kA:
2.0		 4twdA-4n4kA:
21.08
4twdB-4n4kA:
21.08
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.
4TWD_F_377F401_1
(CYS-LOOP
LIGAND-GATED ION
CHANNEL)		 4n4k HYDROXYLAMINE
OXIDOREDUCTASE
(Candidatus
Kuenenia
stuttgartiensis) 		4 / 7 GLU A 219
GLU A 218
TYR A  70
TYR A 498
 None
 0.80A 4twdF-4n4kA:
0.7
4twdJ-4n4kA:
undetectable		 4twdF-4n4kA:
21.08
4twdJ-4n4kA:
21.08
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.
4TWD_H_377H401_1
(CYS-LOOP
LIGAND-GATED ION
CHANNEL)		 4n4k HYDROXYLAMINE
OXIDOREDUCTASE
(Candidatus
Kuenenia
stuttgartiensis) 		4 / 6 TYR A 498
GLU A 219
GLU A 218
TYR A  70
 None
 0.79A 4twdG-4n4kA:
undetectable
4twdH-4n4kA:
undetectable		 4twdG-4n4kA:
21.08
4twdH-4n4kA:
21.08
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.
4TWD_H_377H402_1
(CYS-LOOP
LIGAND-GATED ION
CHANNEL)		 4n4k HYDROXYLAMINE
OXIDOREDUCTASE
(Candidatus
Kuenenia
stuttgartiensis) 		4 / 5 TYR A 498
GLU A 219
GLU A 218
TYR A  70
 None
 0.82A 4twdH-4n4kA:
undetectable
4twdI-4n4kA:
undetectable		 4twdH-4n4kA:
21.08
4twdI-4n4kA:
21.08
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.
4YMG_B_SAMB1001_1
(PUTATIVE
SAM-DEPENDENT
O-METHYLTRANFERASE)		 4n4k HYDROXYLAMINE
OXIDOREDUCTASE
(Candidatus
Kuenenia
stuttgartiensis) 		3 / 3 SER A 489
GLU A 469
GLU A 428
 None
 0.74A 4ymgB-4n4kA:
undetectable		 4ymgB-4n4kA:
21.77
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.
5A06_A_SORA1343_0
(ALDOSE-ALDOSE
OXIDOREDUCTASE)		 4n4k HYDROXYLAMINE
OXIDOREDUCTASE
(Candidatus
Kuenenia
stuttgartiensis) 		4 / 6 ASP A 130
HIS A 241
ARG A 240
ILE A 127
 EDO  A 604 (-3.5A)
HEM  A 608 ( 3.3A)
HEM  A 608 (-3.6A)
HEM  A 608 ( 4.0A)
 1.08A 5a06A-4n4kA:
undetectable		 5a06A-4n4kA:
20.94
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.
5A06_B_SORB1343_0
(ALDOSE-ALDOSE
OXIDOREDUCTASE)		 4n4k HYDROXYLAMINE
OXIDOREDUCTASE
(Candidatus
Kuenenia
stuttgartiensis) 		4 / 5 ASP A 130
HIS A 241
ARG A 240
ILE A 127
 EDO  A 604 (-3.5A)
HEM  A 608 ( 3.3A)
HEM  A 608 (-3.6A)
HEM  A 608 ( 4.0A)
 1.08A 5a06B-4n4kA:
undetectable		 5a06B-4n4kA:
20.94
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.
5A06_D_SORD1344_0
(ALDOSE-ALDOSE
OXIDOREDUCTASE)		 4n4k HYDROXYLAMINE
OXIDOREDUCTASE
(Candidatus
Kuenenia
stuttgartiensis) 		4 / 5 ASP A 130
HIS A 241
ARG A 240
ILE A 127
 EDO  A 604 (-3.5A)
HEM  A 608 ( 3.3A)
HEM  A 608 (-3.6A)
HEM  A 608 ( 4.0A)
 1.08A 5a06D-4n4kA:
undetectable		 5a06D-4n4kA:
20.94
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.
5A06_F_SORF1344_0
(ALDOSE-ALDOSE
OXIDOREDUCTASE)		 4n4k HYDROXYLAMINE
OXIDOREDUCTASE
(Candidatus
Kuenenia
stuttgartiensis) 		4 / 5 ASP A 130
HIS A 241
ARG A 240
ILE A 127
 EDO  A 604 (-3.5A)
HEM  A 608 ( 3.3A)
HEM  A 608 (-3.6A)
HEM  A 608 ( 4.0A)
 1.07A 5a06F-4n4kA:
undetectable		 5a06F-4n4kA:
20.94
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.
5F8Y_A_X6XA202_1
(GALNAC/GAL-SPECIFIC
LECTIN)		 4n4k HYDROXYLAMINE
OXIDOREDUCTASE
(Candidatus
Kuenenia
stuttgartiensis) 		4 / 8 HIS A 403
GLY A 412
GLY A 411
ASP A 529
 None
 0.77A 5f8yA-4n4kA:
undetectable		 5f8yA-4n4kA:
14.26
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.
5F8Y_B_X6XB201_1
(GALNAC/GAL-SPECIFIC
LECTIN)		 4n4k HYDROXYLAMINE
OXIDOREDUCTASE
(Candidatus
Kuenenia
stuttgartiensis) 		4 / 8 HIS A 403
GLY A 412
GLY A 411
ASP A 529
 None
 0.73A 5f8yB-4n4kA:
undetectable		 5f8yB-4n4kA:
14.26
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.
5MRA_B_DM2B204_1
(SORCIN)		 4n4k HYDROXYLAMINE
OXIDOREDUCTASE
(Candidatus
Kuenenia
stuttgartiensis) 		4 / 6 TYR A 278
THR A 252
ARG A 255
GLY A 275
 None
 1.05A 5mraA-4n4kA:
undetectable
5mraB-4n4kA:
undetectable		 5mraA-4n4kA:
13.31
5mraB-4n4kA:
13.31