SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4r1i'

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.
1FM4_A_DXCA1001_0
(MAJOR POLLEN
ALLERGEN BET V 1-L)		 4r1i AMINOBENZOYL-GLUTAMA
TE TRANSPORTER
(Neisseria
gonorrhoeae) 		5 / 12 PHE A  30
PHE A 367
PRO A  95
THR A  98
ALA A 424
 None
 1.28A 1fm4A-4r1iA:
undetectable		 1fm4A-4r1iA:
14.68
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.
1FM4_A_DXCA1001_0
(MAJOR POLLEN
ALLERGEN BET V 1-L)		 4r1i AMINOBENZOYL-GLUTAMA
TE TRANSPORTER
(Neisseria
gonorrhoeae) 		5 / 12 PHE A  30
PHE A 367
THR A  98
GLN A 201
ALA A 203
 None
 1.32A 1fm4A-4r1iA:
undetectable		 1fm4A-4r1iA:
14.68
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.
1LHU_A_ESTA301_1
(SEX HORMONE-BINDING
GLOBULIN)		 4r1i AMINOBENZOYL-GLUTAMA
TE TRANSPORTER
(Neisseria
gonorrhoeae) 		5 / 12 SER A 142
PHE A 137
SER A 126
LEU A 123
LEU A 153
 None
 1.24A 1lhuA-4r1iA:
undetectable		 1lhuA-4r1iA:
15.88
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.
1P91_B_SAMB2401_0
(RIBOSOMAL RNA LARGE
SUBUNIT
METHYLTRANSFERASE A)		 4r1i AMINOBENZOYL-GLUTAMA
TE TRANSPORTER
(Neisseria
gonorrhoeae) 		5 / 12 TYR A 234
LEU A 231
GLY A 139
GLY A 178
PRO A 127
 None
 1.08A 1p91B-4r1iA:
undetectable		 1p91B-4r1iA:
19.62
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.
1SBR_B_VIBB504_1
(YKOF)		 4r1i AMINOBENZOYL-GLUTAMA
TE TRANSPORTER
(Neisseria
gonorrhoeae) 		4 / 6 PRO A  95
LEU A 356
ILE A 360
SER A 415
 None
 1.18A 1sbrA-4r1iA:
undetectable
1sbrB-4r1iA:
undetectable		 1sbrA-4r1iA:
17.67
1sbrB-4r1iA:
17.67
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.
1Y7I_A_SALA501_1
(SALICYLIC
ACID-BINDING PROTEIN
2)		 4r1i AMINOBENZOYL-GLUTAMA
TE TRANSPORTER
(Neisseria
gonorrhoeae) 		5 / 9 GLY A 171
ALA A 173
LEU A 172
LEU A 481
HIS A 167
 None
 1.17A 1y7iA-4r1iA:
undetectable		 1y7iA-4r1iA:
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.
2BFP_D_H4BD1290_1
(PTERIDINE REDUCTASE
1)		 4r1i AMINOBENZOYL-GLUTAMA
TE TRANSPORTER
(Neisseria
gonorrhoeae) 		4 / 8 PHE A 370
LEU A  38
LEU A  79
LEU A  83
 None
 0.96A 2bfpD-4r1iA:
undetectable		 2bfpD-4r1iA:
21.90
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.
2HKK_A_ALEA300_1
(CARBONIC ANHYDRASE 2)		 4r1i AMINOBENZOYL-GLUTAMA
TE TRANSPORTER
(Neisseria
gonorrhoeae) 		4 / 6 ASN A 453
ASN A 410
ILE A 413
GLN A 419
 None
 1.21A 2hkkA-4r1iA:
undetectable		 2hkkA-4r1iA:
17.90
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.
2NNH_A_9CRA501_1
(CYTOCHROME P450 2C8)		 4r1i AMINOBENZOYL-GLUTAMA
TE TRANSPORTER
(Neisseria
gonorrhoeae) 		5 / 11 GLY A  92
ILE A 199
ALA A 424
VAL A 368
ILE A 206
 None
 1.09A 2nnhA-4r1iA:
undetectable		 2nnhA-4r1iA:
19.96
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.
3D2T_B_1FLB500_1
(TRANSTHYRETIN)		 4r1i AMINOBENZOYL-GLUTAMA
TE TRANSPORTER
(Neisseria
gonorrhoeae) 		4 / 6 ALA A 495
LEU A 493
SER A 489
VAL A 228
 None
 1.01A 3d2tB-4r1iA:
undetectable		 3d2tB-4r1iA:
11.88
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.
3EM0_B_CHDB153_0
(ILEAL BILE
ACID-BINDING PROTEIN)		 4r1i AMINOBENZOYL-GLUTAMA
TE TRANSPORTER
(Neisseria
gonorrhoeae) 		4 / 7 ILE A 108
PHE A 188
PHE A 280
GLY A 331
 None
 0.97A 3em0B-4r1iA:
undetectable		 3em0B-4r1iA:
14.40
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.
3G4L_D_ROFD904_1
(CAMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE 4D)		 4r1i AMINOBENZOYL-GLUTAMA
TE TRANSPORTER
(Neisseria
gonorrhoeae) 		3 / 3 ASN A 453
MET A 484
PHE A 176
 None
 0.87A 3g4lD-4r1iA:
undetectable		 3g4lD-4r1iA:
20.57
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.
3TBG_A_RTZA2_1
(CYTOCHROME P450 2D6)		 4r1i AMINOBENZOYL-GLUTAMA
TE TRANSPORTER
(Neisseria
gonorrhoeae) 		5 / 11 THR A 452
LEU A 486
LEU A 411
THR A  15
PHE A 408
 None
 1.31A 3tbgA-4r1iA:
undetectable		 3tbgA-4r1iA:
23.33
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.
3UCB_A_017A201_2
(PROTEASE)		 4r1i AMINOBENZOYL-GLUTAMA
TE TRANSPORTER
(Neisseria
gonorrhoeae) 		5 / 12 LEU A 493
ILE A 455
VAL A  16
ILE A 409
VAL A 451
 None
 1.02A 3ucbB-4r1iA:
undetectable		 3ucbB-4r1iA:
11.20
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.
4XV2_B_P06B801_2
(SERINE/THREONINE-PRO
TEIN KINASE B-RAF)		 4r1i AMINOBENZOYL-GLUTAMA
TE TRANSPORTER
(Neisseria
gonorrhoeae) 		4 / 4 GLY A 198
VAL A  99
PHE A 188
ILE A 319
 None
 1.03A 4xv2B-4r1iA:
undetectable		 4xv2B-4r1iA:
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.
5I8F_A_ML1A210_1
(PHENOLIC OXIDATIVE
COUPLING PROTEIN)		 4r1i AMINOBENZOYL-GLUTAMA
TE TRANSPORTER
(Neisseria
gonorrhoeae) 		5 / 12 LEU A 356
LEU A  29
VAL A 422
TYR A 445
GLY A 414
 None
 1.26A 5i8fA-4r1iA:
undetectable		 5i8fA-4r1iA:
14.82
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.
5O4Y_F_CCSF14_0
(PHE-MAA-ASN-PRO-HIS-
LEU-SER-TRP-SER-TRP-
9KK-9KK-ARG-CCS-GLY-
NH2)		 4r1i AMINOBENZOYL-GLUTAMA
TE TRANSPORTER
(Neisseria
gonorrhoeae) 		4 / 6 PHE A 492
LEU A 493
SER A 450
GLY A 448
 None
 1.11A 5o4yF-4r1iA:
undetectable		 5o4yF-4r1iA:
2.74
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.
5XV7_A_EMHA705_2
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)		 4r1i AMINOBENZOYL-GLUTAMA
TE TRANSPORTER
(Neisseria
gonorrhoeae) 		4 / 4 VAL A  35
LEU A  38
LEU A  73
ASP A  75
 None
 1.05A 5xv7A-4r1iA:
undetectable		 5xv7A-4r1iA:
11.09
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.
6H7L_A_Y00A406_1
(BETA-1 ADRENERGIC
RECEPTOR)		 4r1i AMINOBENZOYL-GLUTAMA
TE TRANSPORTER
(Neisseria
gonorrhoeae) 		4 / 6 GLY A  44
LEU A  49
PHE A 371
PHE A 367
 None
 1.01A 6h7lA-4r1iA:
undetectable		 6h7lA-4r1iA:
10.94
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.
6H7L_B_Y00B405_1
(BETA-1 ADRENERGIC
RECEPTOR)		 4r1i AMINOBENZOYL-GLUTAMA
TE TRANSPORTER
(Neisseria
gonorrhoeae) 		4 / 6 GLY A  44
LEU A  49
PHE A 371
PHE A 367
 None
 1.03A 6h7lB-4r1iA:
undetectable		 6h7lB-4r1iA:
10.94