SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4k91'

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.
2ADM_A_SAMA500_0
(ADENINE-N6-DNA-METHY
LTRANSFERASE TAQI)		 4k91 D-ALA-D-ALA-CARBOXYP
EPTIDASE
(Pseudomonas
aeruginosa) 		5 / 11 THR A  75
GLU A 111
ALA A 110
ILE A  50
ALA A 121
 None
 1.35A 2admA-4k91A:
undetectable		 2admA-4k91A:
22.84
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.
2ADM_B_SAMB500_0
(ADENINE-N6-DNA-METHY
LTRANSFERASE TAQI)		 4k91 D-ALA-D-ALA-CARBOXYP
EPTIDASE
(Pseudomonas
aeruginosa) 		5 / 11 THR A  75
GLU A 111
ALA A 110
ILE A  50
ALA A 121
 None
 1.32A 2admB-4k91A:
undetectable		 2admB-4k91A:
22.84
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.
2BXG_A_IBPA2002_1
(SERUM ALBUMIN)		 4k91 D-ALA-D-ALA-CARBOXYP
EPTIDASE
(Pseudomonas
aeruginosa) 		4 / 8 ALA A 237
ALA A  13
LEU A 214
VAL A 229
 None
 0.91A 2bxgA-4k91A:
undetectable		 2bxgA-4k91A:
19.93
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.
2NMZ_B_ROCB401_2
(PROTEASE)		 4k91 D-ALA-D-ALA-CARBOXYP
EPTIDASE
(Pseudomonas
aeruginosa) 		3 / 3 ARG A 189
VAL A 107
THR A  75
 SIN  A 601 ( 4.7A)
None
None
 0.73A 2nmzA-4k91A:
undetectable		 2nmzA-4k91A:
14.54
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.
2X45_A_HSMA1160_1
(ALLERGEN ARG R 1)		 4k91 D-ALA-D-ALA-CARBOXYP
EPTIDASE
(Pseudomonas
aeruginosa) 		4 / 6 SER A 217
TYR A 171
TYR A 165
ASP A 200
 None
 1.43A 2x45A-4k91A:
undetectable		 2x45A-4k91A:
15.43
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.
3K4V_D_ROCD201_4
(HIV-1 PROTEASE)		 4k91 D-ALA-D-ALA-CARBOXYP
EPTIDASE
(Pseudomonas
aeruginosa) 		3 / 3 ARG A 189
VAL A 107
THR A  75
 SIN  A 601 ( 4.7A)
None
None
 0.72A 3k4vD-4k91A:
undetectable		 3k4vD-4k91A:
14.84
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.
3LN1_D_CELD682_2
(PROSTAGLANDIN G/H
SYNTHASE 2)		 4k91 D-ALA-D-ALA-CARBOXYP
EPTIDASE
(Pseudomonas
aeruginosa) 		4 / 5 ARG A 238
LEU A  45
ARG A 189
ILE A  99
 SIN  A 601 ( 4.8A)
None
SIN  A 601 ( 4.7A)
None
 1.19A 3ln1D-4k91A:
undetectable		 3ln1D-4k91A:
20.22
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.
3LZV_A_017A200_2
(HIV-1 PROTEASE)		 4k91 D-ALA-D-ALA-CARBOXYP
EPTIDASE
(Pseudomonas
aeruginosa) 		5 / 11 ALA A 337
ASN A 339
VAL A 341
GLY A 268
ILE A 312
 None
 0.68A 3lzvB-4k91A:
undetectable		 3lzvB-4k91A:
13.20
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3MZE_A_CFXA364_1
(D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE
DACA)		 4k91 D-ALA-D-ALA-CARBOXYP
EPTIDASE
(Pseudomonas
aeruginosa) 		6 / 12 ALA A  40
SER A  41
GLY A  76
ARG A 189
THR A 204
GLY A 205
 SIN  A 601 (-3.2A)
SIN  A 601 (-2.9A)
None
SIN  A 601 ( 4.7A)
SIN  A 601 (-3.8A)
SIN  A 601 (-3.2A)
 1.21A 3mzeA-4k91A:
42.1		 3mzeA-4k91A:
47.90
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3MZE_A_CFXA364_1
(D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE
DACA)		 4k91 D-ALA-D-ALA-CARBOXYP
EPTIDASE
(Pseudomonas
aeruginosa) 		8 / 12 ALA A  40
SER A  41
LYS A  44
ASN A 103
ARG A 189
THR A 204
GLY A 205
THR A 207
 SIN  A 601 (-3.2A)
SIN  A 601 (-2.9A)
None
None
SIN  A 601 ( 4.7A)
SIN  A 601 (-3.8A)
SIN  A 601 (-3.2A)
None
 0.78A 3mzeA-4k91A:
42.1		 3mzeA-4k91A:
47.90
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.
3SH8_A_CEDA1_1
(BETA-LACTAMASE)		 4k91 D-ALA-D-ALA-CARBOXYP
EPTIDASE
(Pseudomonas
aeruginosa) 		6 / 12 ALA A  40
SER A  41
SER A 101
ASN A 103
THR A 204
GLY A 205
 SIN  A 601 (-3.2A)
SIN  A 601 (-2.9A)
SIN  A 601 ( 4.2A)
None
SIN  A 601 (-3.8A)
SIN  A 601 (-3.2A)
 0.78A 3sh8A-4k91A:
23.0		 3sh8A-4k91A:
24.16
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.
3VNS_A_DVAA602_0
(NRPS ADENYLATION
PROTEIN CYTC1)		 4k91 D-ALA-D-ALA-CARBOXYP
EPTIDASE
(Pseudomonas
aeruginosa) 		4 / 7 ASP A  21
GLY A 222
THR A 289
PHE A 250
 None
 1.12A 3vnsA-4k91A:
undetectable		 3vnsA-4k91A:
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.
3W68_A_VIVA301_0
(ALPHA-TOCOPHEROL
TRANSFER PROTEIN)		 4k91 D-ALA-D-ALA-CARBOXYP
EPTIDASE
(Pseudomonas
aeruginosa) 		5 / 12 LEU A  42
SER A 151
ILE A 226
VAL A 228
PHE A 230
 None
 1.20A 3w68A-4k91A:
undetectable		 3w68A-4k91A:
20.00
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.
4A97_D_ZPCD1318_1
(CYS-LOOP
LIGAND-GATED ION
CHANNEL)		 4k91 D-ALA-D-ALA-CARBOXYP
EPTIDASE
(Pseudomonas
aeruginosa) 		4 / 8 PHE A 230
VAL A 228
MET A  20
ILE A 226
 None
 1.06A 4a97C-4k91A:
undetectable		 4a97C-4k91A:
20.55
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.
4BWL_C_MN9C1297_0
(N-ACETYLNEURAMINATE
LYASE)		 4k91 D-ALA-D-ALA-CARBOXYP
EPTIDASE
(Pseudomonas
aeruginosa) 		5 / 10 ILE A  97
THR A  47
ASP A 140
GLU A 117
GLY A 143
 None
 0.99A 4bwlC-4k91A:
undetectable		 4bwlC-4k91A:
23.94
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.
5K9D_A_ACTA405_0
(DIHYDROOROTATE
DEHYDROGENASE
(QUINONE),
MITOCHONDRIAL)		 4k91 D-ALA-D-ALA-CARBOXYP
EPTIDASE
(Pseudomonas
aeruginosa) 		3 / 3 GLN A 223
THR A 289
ASP A  21
 None
 0.89A 5k9dA-4k91A:
undetectable		 5k9dA-4k91A:
26.43
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.
5M54_B_TA1B502_1
(TUBULIN BETA-2B
CHAIN)		 4k91 D-ALA-D-ALA-CARBOXYP
EPTIDASE
(Pseudomonas
aeruginosa) 		5 / 12 HIS A 149
ALA A 141
SER A 106
PHE A 120
THR A 126
 None
 1.47A 5m54B-4k91A:
undetectable		 5m54B-4k91A:
20.56
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.
5MQT_A_STIA302_1
(DEOXYCYTIDINE KINASE)		 4k91 D-ALA-D-ALA-CARBOXYP
EPTIDASE
(Pseudomonas
aeruginosa) 		5 / 12 VAL A 219
TYR A 165
PRO A 168
GLU A 167
GLU A  23
 None
 1.22A 5mqtA-4k91A:
undetectable		 5mqtA-4k91A:
21.63
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.
5N0S_B_SAMB501_0
(PEPTIDE
N-METHYLTRANSFERASE)		 4k91 D-ALA-D-ALA-CARBOXYP
EPTIDASE
(Pseudomonas
aeruginosa) 		5 / 12 ILE A  97
VAL A  88
VAL A  68
ILE A  50
ALA A  48
 None
 1.15A 5n0sB-4k91A:
undetectable		 5n0sB-4k91A:
21.58
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.
6DH0_A_017A101_1
(PROTEASE)		 4k91 D-ALA-D-ALA-CARBOXYP
EPTIDASE
(Pseudomonas
aeruginosa) 		5 / 12 ALA A  72
GLY A 102
ILE A  97
VAL A  88
VAL A  68
 None
 1.05A 6dh0B-4k91A:
undetectable		 6dh0B-4k91A:
13.65
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_C_AQ4C602_1
(CYTOCHROME P450 1A1)		 4k91 D-ALA-D-ALA-CARBOXYP
EPTIDASE
(Pseudomonas
aeruginosa) 		3 / 3 SER A 136
SER A 151
ALA A 160
 None
 0.69A 6dwnC-4k91A:
undetectable		 6dwnC-4k91A:
13.29