SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2c91'

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.
1JG4_A_SAMA500_0
(PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE)		 2c91 AFLATOXIN B1
ALDEHYDE REDUCTASE
MEMBER 2
(Mus
musculus) 		5 / 12 THR A  12
GLY A 137
THR A  72
ALA A  71
LEU A 105
 None
 1.11A 1jg4A-2c91A:
undetectable		 1jg4A-2c91A:
20.23
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.
2BXF_A_DZPA2001_1
(SERUM ALBUMIN)		 2c91 AFLATOXIN B1
ALDEHYDE REDUCTASE
MEMBER 2
(Mus
musculus) 		5 / 12 LEU A 288
LEU A 291
GLU A 299
LEU A 295
ARG A  34
 None
 1.14A 2bxfA-2c91A:
undetectable		 2bxfA-2c91A:
19.23
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.
2CIZ_A_ACTA1320_0
(CHLOROPEROXIDASE)		 2c91 AFLATOXIN B1
ALDEHYDE REDUCTASE
MEMBER 2
(Mus
musculus) 		4 / 6 ALA A 263
ILE A 241
VAL A 244
GLU A 245
 None
 0.96A 2cizA-2c91A:
undetectable		 2cizA-2c91A:
20.50
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.
2W98_B_P1ZB1359_1
(PROSTAGLANDIN
REDUCTASE 2)		 2c91 AFLATOXIN B1
ALDEHYDE REDUCTASE
MEMBER 2
(Mus
musculus) 		4 / 6 THR A 227
GLU A 226
LYS A 210
PHE A 220
 GOL  A 361 ( 4.6A)
None
None
None
 1.37A 2w98B-2c91A:
undetectable		 2w98B-2c91A:
22.31
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.
3DCJ_B_THHB401_0
(PROBABLE
5'-PHOSPHORIBOSYLGLY
CINAMIDE
FORMYLTRANSFERASE
PURN)		 2c91 AFLATOXIN B1
ALDEHYDE REDUCTASE
MEMBER 2
(Mus
musculus) 		4 / 8 LEU A  59
THR A  72
VAL A  68
GLY A  62
 None
 0.79A 3dcjB-2c91A:
undetectable		 3dcjB-2c91A:
22.36
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.
3DH0_B_SAMB300_0
(SAM DEPENDENT
METHYLTRANSFERASE)		 2c91 AFLATOXIN B1
ALDEHYDE REDUCTASE
MEMBER 2
(Mus
musculus) 		5 / 12 ARG A 218
GLY A  11
GLY A 284
THR A  12
LEU A  54
 NAP  A 350 (-3.0A)
NAP  A 350 (-3.1A)
NAP  A 350 (-3.6A)
None
None
 1.02A 3dh0B-2c91A:
undetectable		 3dh0B-2c91A:
23.05
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.
3PO7_A_ZONA601_1
(AMINE OXIDASE
[FLAVIN-CONTAINING]
B)		 2c91 AFLATOXIN B1
ALDEHYDE REDUCTASE
MEMBER 2
(Mus
musculus) 		4 / 8 LEU A 183
CYH A 182
TYR A 164
PHE A 190
 None
 1.28A 3po7A-2c91A:
undetectable		 3po7A-2c91A:
19.17
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.
3Q5S_A_ACHA1289_0
(MULTIDRUG-EFFLUX
TRANSPORTER 1
REGULATOR)		 2c91 AFLATOXIN B1
ALDEHYDE REDUCTASE
MEMBER 2
(Mus
musculus) 		4 / 6 VAL A 163
TYR A 107
TYR A 191
GLU A  38
 None
 0.79A 3q5sA-2c91A:
undetectable		 3q5sA-2c91A:
19.54
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.
3QXY_A_SAMA6734_0
(N-LYSINE
METHYLTRANSFERASE
SETD6)		 2c91 AFLATOXIN B1
ALDEHYDE REDUCTASE
MEMBER 2
(Mus
musculus) 		5 / 12 VAL A 281
ALA A 280
TYR A 107
TYR A 164
PHE A 190
 None
 1.16A 3qxyA-2c91A:
undetectable		 3qxyA-2c91A:
23.55
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.
3QXY_B_SAMB6735_0
(N-LYSINE
METHYLTRANSFERASE
SETD6
TRANSCRIPTION FACTOR
P65)		 2c91 AFLATOXIN B1
ALDEHYDE REDUCTASE
MEMBER 2
(Mus
musculus) 		5 / 11 VAL A 281
ALA A 280
TYR A 107
TYR A 164
PHE A 190
 None
 1.13A 3qxyB-2c91A:
undetectable
3qxyQ-2c91A:
undetectable		 3qxyB-2c91A:
23.55
3qxyQ-2c91A:
6.02
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.
3RC0_A_SAMA484_0
(N-LYSINE
METHYLTRANSFERASE
SETD6)		 2c91 AFLATOXIN B1
ALDEHYDE REDUCTASE
MEMBER 2
(Mus
musculus) 		5 / 11 VAL A 281
ALA A 280
TYR A 107
TYR A 164
PHE A 190
 None
 1.14A 3rc0A-2c91A:
undetectable		 3rc0A-2c91A:
23.55
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.
3RC0_B_SAMB480_0
(N-LYSINE
METHYLTRANSFERASE
SETD6)		 2c91 AFLATOXIN B1
ALDEHYDE REDUCTASE
MEMBER 2
(Mus
musculus) 		5 / 12 VAL A 281
ALA A 280
TYR A 107
TYR A 164
PHE A 190
 None
 1.14A 3rc0B-2c91A:
undetectable		 3rc0B-2c91A:
23.55
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.
3TYE_B_YTZB902_1
(DIHYDROPTEROATE
SYNTHASE)		 2c91 AFLATOXIN B1
ALDEHYDE REDUCTASE
MEMBER 2
(Mus
musculus) 		3 / 3 PHE A  43
LYS A  80
SER A  81
 None
 1.23A 3tyeB-2c91A:
9.4		 3tyeB-2c91A:
20.11
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.
4A7B_B_HAEB1270_1
(COLLAGENASE 3)		 2c91 AFLATOXIN B1
ALDEHYDE REDUCTASE
MEMBER 2
(Mus
musculus) 		4 / 5 HIS A 237
HIS A 320
GLU A 321
HIS A 236
 None
 1.38A 4a7bB-2c91A:
undetectable		 4a7bB-2c91A:
17.75
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.
4ACB_C_DXCC1477_0
(TRANSLATION
ELONGATION FACTOR
SELB)		 2c91 AFLATOXIN B1
ALDEHYDE REDUCTASE
MEMBER 2
(Mus
musculus) 		4 / 6 THR A  41
GLY A  11
ILE A 282
LEU A  39
 None
NAP  A 350 (-3.1A)
NAP  A 350 (-3.6A)
None
 1.02A 4acbC-2c91A:
3.1		 4acbC-2c91A:
21.26
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.
4IAQ_A_2GMA2001_1
(CHIMERA PROTEIN OF
HUMAN
5-HYDROXYTRYPTAMINE
RECEPTOR 1B AND E.
COLI SOLUBLE
CYTOCHROME B562)		 2c91 AFLATOXIN B1
ALDEHYDE REDUCTASE
MEMBER 2
(Mus
musculus) 		5 / 12 LEU A  32
VAL A  28
ALA A  71
MET A 285
THR A   8
 None
 1.38A 4iaqA-2c91A:
undetectable		 4iaqA-2c91A:
22.78
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.
4MBS_A_MRVA1101_2
(CHIMERA PROTEIN OF
C-C CHEMOKINE
RECEPTOR TYPE 5 AND
RUBREDOXIN)		 2c91 AFLATOXIN B1
ALDEHYDE REDUCTASE
MEMBER 2
(Mus
musculus) 		4 / 7 TYR A 205
THR A 298
THR A   8
THR A 171
 None
 1.14A 4mbsA-2c91A:
undetectable		 4mbsA-2c91A:
21.05
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.
4WNV_D_QI9D602_0
(CYTOCHROME P450 2D6)		 2c91 AFLATOXIN B1
ALDEHYDE REDUCTASE
MEMBER 2
(Mus
musculus) 		4 / 7 PHE A 190
LEU A 183
VAL A 175
PHE A 326
 None
 1.00A 4wnvD-2c91A:
undetectable		 4wnvD-2c91A:
21.13
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.
5C0O_F_SAMF301_0
(TRNA
(ADENINE(58)-N(1))-M
ETHYLTRANSFERASE
TRMI)		 2c91 AFLATOXIN B1
ALDEHYDE REDUCTASE
MEMBER 2
(Mus
musculus) 		5 / 12 GLY A  55
GLY A  56
LEU A  57
GLU A  51
ALA A  42
 None
 0.98A 5c0oF-2c91A:
undetectable		 5c0oF-2c91A:
22.44
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.
5G48_B_1FLB1375_1
(DNA POLYMERASE III
SUBUNIT BETA)		 2c91 AFLATOXIN B1
ALDEHYDE REDUCTASE
MEMBER 2
(Mus
musculus) 		5 / 9 LEU A  82
THR A 120
LEU A 121
ILE A 149
LEU A 152
 None
 1.25A 5g48B-2c91A:
undetectable		 5g48B-2c91A:
23.76