SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4qhr'

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.
1DMA_A_NCAA700_0
(EXOTOXIN A)		 4qhr ALANINE RACEMASE
(Acinetobacter
baumannii) 		4 / 7 HIS A  40
GLY A  39
ALA A  37
TYR A  38
 None
None
None
LLP  A  34 ( 4.5A)
 0.89A 1dmaA-4qhrA:
undetectable		 1dmaA-4qhrA:
19.60
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)		 4qhr ALANINE RACEMASE
(Acinetobacter
baumannii) 		5 / 12 LEU A 347
MET A 234
ILE A   8
GLY A  41
HIS A  40
 None
 1.17A 1g50B-4qhrA:
undetectable		 1g50B-4qhrA:
19.18
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)		 4qhr ALANINE RACEMASE
(Acinetobacter
baumannii) 		5 / 11 LEU A 347
MET A 234
ILE A   8
GLY A  41
HIS A  40
 None
 1.16A 1g50C-4qhrA:
undetectable		 1g50C-4qhrA:
19.18
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.
1KF6_B_ACTB704_0
(FUMARATE REDUCTASE
FLAVOPROTEIN
FUMARATE REDUCTASE
IRON-SULFUR PROTEIN)		 4qhr ALANINE RACEMASE
(Acinetobacter
baumannii) 		3 / 3 ARG A   2
GLY A 272
ASP A 275
 None
 0.59A 1kf6A-4qhrA:
undetectable
1kf6B-4qhrA:
undetectable		 1kf6A-4qhrA:
20.58
1kf6B-4qhrA:
19.34
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.
1KF6_B_ACTB704_0
(FUMARATE REDUCTASE
FLAVOPROTEIN
FUMARATE REDUCTASE
IRON-SULFUR PROTEIN)		 4qhr ALANINE RACEMASE
(Acinetobacter
baumannii) 		3 / 3 ARG A   2
GLY A 274
ASP A 275
 None
 0.49A 1kf6A-4qhrA:
undetectable
1kf6B-4qhrA:
undetectable		 1kf6A-4qhrA:
20.58
1kf6B-4qhrA:
19.34
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.
1SA1_B_PODB700_1
(TUBULIN ALPHA CHAIN
TUBULIN BETA CHAIN)		 4qhr ALANINE RACEMASE
(Acinetobacter
baumannii) 		5 / 12 ALA A  48
LEU A  17
ASN A  16
VAL A  33
ALA A  37
 None
None
None
LLP  A  34 ( 3.3A)
None
 0.98A 1sa1A-4qhrA:
undetectable
1sa1B-4qhrA:
undetectable		 1sa1A-4qhrA:
21.24
1sa1B-4qhrA:
22.60
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.
1SA1_D_PODD701_1
(TUBULIN ALPHA CHAIN
TUBULIN BETA CHAIN)		 4qhr ALANINE RACEMASE
(Acinetobacter
baumannii) 		5 / 12 ALA A  48
LEU A  17
ASN A  16
VAL A  33
ALA A  37
 None
None
None
LLP  A  34 ( 3.3A)
None
 0.98A 1sa1C-4qhrA:
undetectable
1sa1D-4qhrA:
undetectable		 1sa1C-4qhrA:
21.24
1sa1D-4qhrA:
22.60
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.
1VPO_H_TESH1010_1
(ANTI-TESTOSTERONE
(HEAVY CHAIN)
ANTI-TESTOSTERONE
(LIGHT CHAIN))		 4qhr ALANINE RACEMASE
(Acinetobacter
baumannii) 		5 / 12 SER A 194
ALA A 217
TYR A  38
GLY A 216
LEU A 230
 LLP  A  34 ( 2.4A)
None
LLP  A  34 ( 4.5A)
None
None
 1.04A 1vpoH-4qhrA:
undetectable
1vpoL-4qhrA:
undetectable		 1vpoH-4qhrA:
18.51
1vpoL-4qhrA:
19.89
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.
2JST_A_HLTA101_1
(FOUR-ALPHA-HELIX
BUNDLE)		 4qhr ALANINE RACEMASE
(Acinetobacter
baumannii) 		4 / 5 TRP A 200
ALA A 195
LEU A 203
ALA A 163
 None
 1.29A 2jstA-4qhrA:
undetectable
2jstB-4qhrA:
undetectable		 2jstA-4qhrA:
10.66
2jstB-4qhrA:
10.66
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.
2NV4_B_SAMB202_0
(UPF0066 PROTEIN
AF_0241)		 4qhr ALANINE RACEMASE
(Acinetobacter
baumannii) 		5 / 12 ALA A 333
GLY A 216
LEU A 230
ASP A 330
LEU A 343
 None
 1.33A 2nv4B-4qhrA:
2.3		 2nv4B-4qhrA:
15.28
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.
2RKG_B_AB1B501_2
(PROTEASE RETROPEPSIN)		 4qhr ALANINE RACEMASE
(Acinetobacter
baumannii) 		5 / 12 GLY A 249
ALA A 260
ILE A 266
VAL A 297
ILE A 246
 None
 0.84A 2rkgB-4qhrA:
undetectable		 2rkgB-4qhrA:
13.07
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.
3BGD_B_PM6B301_1
(THIOPURINE
S-METHYLTRANSFERASE)		 4qhr ALANINE RACEMASE
(Acinetobacter
baumannii) 		4 / 8 PHE A  55
GLY A  56
LEU A  77
ARG A  67
 None
 1.14A 3bgdB-4qhrA:
undetectable		 3bgdB-4qhrA:
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.
3CL9_A_MTXA602_1
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE (DHFR-TS))		 4qhr ALANINE RACEMASE
(Acinetobacter
baumannii) 		5 / 12 ALA A 267
ILE A 289
PHE A 236
PRO A 351
ARG A   2
 None
 1.20A 3cl9A-4qhrA:
undetectable		 3cl9A-4qhrA:
20.85
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.
3IV6_C_SAMC301_0
(PUTATIVE
ZN-DEPENDENT ALCOHOL
DEHYDROGENASE)		 4qhr ALANINE RACEMASE
(Acinetobacter
baumannii) 		5 / 12 TRP A 323
GLY A 340
THR A 338
ILE A 212
ARG A 346
 None
None
None
LLP  A  34 ( 3.9A)
None
 1.27A 3iv6C-4qhrA:
undetectable		 3iv6C-4qhrA:
21.60
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.
3IV6_D_SAMD301_0
(PUTATIVE
ZN-DEPENDENT ALCOHOL
DEHYDROGENASE)		 4qhr ALANINE RACEMASE
(Acinetobacter
baumannii) 		5 / 12 TRP A 323
GLY A 340
THR A 338
ILE A 212
ARG A 346
 None
None
None
LLP  A  34 ( 3.9A)
None
 1.15A 3iv6D-4qhrA:
undetectable		 3iv6D-4qhrA:
21.60
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.
3JB2_A_SAMA1102_0
(STRUCTURAL PROTEIN
VP3)		 4qhr ALANINE RACEMASE
(Acinetobacter
baumannii) 		6 / 12 ILE A  66
GLY A  63
ALA A  90
PHE A  55
ALA A  58
VAL A  57
 None
None
None
None
LLP  A  34 ( 3.9A)
LLP  A  34 ( 4.8A)
 1.29A 3jb2A-4qhrA:
undetectable		 3jb2A-4qhrA:
15.89
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.
3JB3_A_SAMA1102_0
(STRUCTURAL PROTEIN
VP3)		 4qhr ALANINE RACEMASE
(Acinetobacter
baumannii) 		6 / 12 ILE A  66
GLY A  63
ALA A  90
PHE A  55
ALA A  58
VAL A  57
 None
None
None
None
LLP  A  34 ( 3.9A)
LLP  A  34 ( 4.8A)
 1.34A 3jb3A-4qhrA:
undetectable		 3jb3A-4qhrA:
15.89
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.
3S43_A_478A401_2
(PROTEASE)		 4qhr ALANINE RACEMASE
(Acinetobacter
baumannii) 		5 / 10 GLY A 249
ALA A 260
ILE A 266
VAL A 297
ILE A 246
 None
 0.89A 3s43B-4qhrA:
undetectable		 3s43B-4qhrA:
14.20
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.
3V4T_A_ACTA505_0
(UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE)		 4qhr ALANINE RACEMASE
(Acinetobacter
baumannii) 		3 / 3 THR A 338
ASN A 336
GLU A 342
 None
 0.42A 3v4tA-4qhrA:
undetectable
3v4tC-4qhrA:
undetectable		 3v4tA-4qhrA:
22.96
3v4tC-4qhrA:
22.96
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.
4AX8_A_SAMA1474_1
(WBDD)		 4qhr ALANINE RACEMASE
(Acinetobacter
baumannii) 		4 / 6 TYR A  15
ASP A   9
GLU A 321
LEU A 230
 None
 1.06A 4ax8A-4qhrA:
undetectable		 4ax8A-4qhrA:
22.05
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.
4J4V_A_SVRA301_1
(NUCLEOCAPSID PROTEIN)		 4qhr ALANINE RACEMASE
(Acinetobacter
baumannii) 		5 / 11 GLY A 274
ALA A 280
PRO A 351
PHE A 236
ILE A 271
 None
 1.00A 4j4vA-4qhrA:
undetectable		 4j4vA-4qhrA:
20.40
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.
4J4V_C_SVRC301_1
(NUCLEOCAPSID PROTEIN)		 4qhr ALANINE RACEMASE
(Acinetobacter
baumannii) 		4 / 8 GLY A 274
PRO A 351
PHE A 236
ILE A 271
 None
 0.92A 4j4vC-4qhrA:
undetectable		 4j4vC-4qhrA:
20.40
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.
4O8F_A_BRLA501_2
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)		 4qhr ALANINE RACEMASE
(Acinetobacter
baumannii) 		4 / 5 GLY A 119
ILE A  91
LEU A 108
LEU A 188
 None
 0.83A 4o8fA-4qhrA:
undetectable		 4o8fA-4qhrA:
23.04
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.
4X20_B_LOCB502_1
(TUBULIN BETA CHAIN)		 4qhr ALANINE RACEMASE
(Acinetobacter
baumannii) 		5 / 12 ALA A  48
LEU A  17
ASN A  16
VAL A  33
ALA A  37
 None
None
None
LLP  A  34 ( 3.3A)
None
 0.99A 4x20B-4qhrA:
undetectable		 4x20B-4qhrA:
22.60
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.
4X3U_B_SVRB102_1
(CHROMOBOX PROTEIN
HOMOLOG 7)		 4qhr ALANINE RACEMASE
(Acinetobacter
baumannii) 		3 / 3 LYS A 181
ARG A 209
VAL A 208
 None
LLP  A  34 ( 3.9A)
None
 1.05A 4x3uA-4qhrA:
0.3
4x3uB-4qhrA:
0.6		 4x3uA-4qhrA:
10.67
4x3uB-4qhrA:
10.67
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.
5BXN_V_BO2V301_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-3)		 4qhr ALANINE RACEMASE
(Acinetobacter
baumannii) 		5 / 11 THR A 312
THR A 318
GLN A 319
GLY A 291
ALA A 288
 None
 1.21A 5bxnV-4qhrA:
undetectable
5bxnW-4qhrA:
undetectable		 5bxnV-4qhrA:
22.28
5bxnW-4qhrA:
21.39
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.
5HS6_A_J3ZA302_1
(17-BETA-HYDROXYSTERO
ID DEHYDROGENASE 14)		 4qhr ALANINE RACEMASE
(Acinetobacter
baumannii) 		4 / 8 GLN A 175
TRP A 200
LEU A 203
MET A 158
 None
 1.18A 5hs6A-4qhrA:
2.7		 5hs6A-4qhrA:
21.78
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.
5KQY_B_017B101_1
(PROTEASE E35D-DRV)		 4qhr ALANINE RACEMASE
(Acinetobacter
baumannii) 		5 / 12 ASP A 308
VAL A 297
ILE A 266
ILE A 241
VAL A 300
 None
 0.93A 5kqyA-4qhrA:
undetectable		 5kqyA-4qhrA:
13.91
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.
5MUR_E_PFLE406_1
(PROTON-GATED ION
CHANNEL)		 4qhr ALANINE RACEMASE
(Acinetobacter
baumannii) 		5 / 10 ILE A 271
ILE A 305
ILE A 268
ILE A 241
ILE A 240
 None
 1.12A 5murE-4qhrA:
undetectable		 5murE-4qhrA:
14.47
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.
5MVS_A_ADNA401_1
(HISTONE-LYSINE
N-METHYLTRANSFERASE,
H3 LYSINE-79
SPECIFIC)		 4qhr ALANINE RACEMASE
(Acinetobacter
baumannii) 		4 / 7 GLY A 324
GLU A 321
ALA A 288
ASP A 331
 None
 0.97A 5mvsA-4qhrA:
undetectable		 5mvsA-4qhrA:
20.68
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.
5NNA_B_BZMB301_0
(ISATIN HYDROLASE A)		 4qhr ALANINE RACEMASE
(Acinetobacter
baumannii) 		5 / 12 LEU A  49
PRO A 210
SER A 194
GLY A 211
HIS A  40
 None
None
LLP  A  34 ( 2.4A)
LLP  A  34 ( 3.4A)
None
 1.15A 5nnaB-4qhrA:
undetectable		 5nnaB-4qhrA:
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.
5O96_H_SAMH501_0
(RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE E)		 4qhr ALANINE RACEMASE
(Acinetobacter
baumannii) 		5 / 10 PRO A 351
GLY A 272
GLY A 276
VAL A   6
ALA A 238
 None
 0.83A 5o96G-4qhrA:
undetectable
5o96H-4qhrA:
undetectable		 5o96G-4qhrA:
22.01
5o96H-4qhrA:
22.01
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.
5T8H_B_478B401_1
(PROTEASE)		 4qhr ALANINE RACEMASE
(Acinetobacter
baumannii) 		5 / 12 GLY A 249
ALA A 260
ILE A 266
VAL A 297
ILE A 246
 None
 0.89A 5t8hA-4qhrA:
undetectable		 5t8hA-4qhrA:
14.20