SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4cz1'

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.
1ICR_A_NIOA604_1
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)		 4cz1 KYNURENINE
FORMAMIDASE
(Bacillus
anthracis) 		4 / 5 SER A  27
THR A  46
GLU A  29
GLY A  43
 None
 1.32A 1icrA-4cz1A:
undetectable
1icrB-4cz1A:
undetectable		 1icrA-4cz1A:
22.22
1icrB-4cz1A:
22.22
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.
209D_C_DVAC2_0
(N8-ACTINOMYCIN D)		 4cz1 KYNURENINE
FORMAMIDASE
(Bacillus
anthracis) 		3 / 3 THR A  53
PRO A 201
THR A  51
 None
 0.78A 209dC-4cz1A:
undetectable		 209dC-4cz1A:
6.06
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.
2QO4_A_CHDA130_0
(LIVER-BASIC FATTY
ACID BINDING PROTEIN)		 4cz1 KYNURENINE
FORMAMIDASE
(Bacillus
anthracis) 		5 / 12 LEU A 142
ILE A 143
ALA A 189
VAL A 202
HIS A 161
 None
None
None
None
ZN  A 401 (-3.4A)
 1.19A 2qo4A-4cz1A:
undetectable		 2qo4A-4cz1A:
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.
2QO6_A_CHDA130_0
(LIVER-BASIC FATTY
ACID BINDING PROTEIN)		 4cz1 KYNURENINE
FORMAMIDASE
(Bacillus
anthracis) 		5 / 12 LEU A 142
ILE A 143
ALA A 189
VAL A 202
HIS A 161
 None
None
None
None
ZN  A 401 (-3.4A)
 1.21A 2qo6A-4cz1A:
undetectable		 2qo6A-4cz1A:
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.
3A7E_A_SAMA216_1
(CATECHOL
O-METHYLTRANSFERASE)		 4cz1 KYNURENINE
FORMAMIDASE
(Bacillus
anthracis) 		4 / 6 SER A  48
ILE A  55
GLU A 173
ILE A 171
 None
None
ZN  A 401 ( 2.1A)
None
 0.99A 3a7eA-4cz1A:
undetectable		 3a7eA-4cz1A:
22.61
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.
3BJW_F_SVRF502_2
(PHOSPHOLIPASE A2)		 4cz1 KYNURENINE
FORMAMIDASE
(Bacillus
anthracis) 		4 / 5 ILE A  49
SER A 200
PRO A 201
PRO A 191
 None
 1.18A 3bjwC-4cz1A:
undetectable		 3bjwC-4cz1A:
17.70
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.
3FUU_A_ADNA0_1
(DIMETHYLADENOSINE
TRANSFERASE)		 4cz1 KYNURENINE
FORMAMIDASE
(Bacillus
anthracis) 		5 / 12 VAL A  68
ASP A  72
ALA A  57
PRO A 191
ILE A  55
 None
 0.86A 3fuuA-4cz1A:
undetectable		 3fuuA-4cz1A:
21.25
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.
3IJD_B_C2FB314_0
(UNCHARACTERIZED
PROTEIN)		 4cz1 KYNURENINE
FORMAMIDASE
(Bacillus
anthracis) 		5 / 12 LEU A 142
VAL A 104
ILE A 209
LEU A 187
ILE A 206
 None
 1.14A 3ijdB-4cz1A:
undetectable		 3ijdB-4cz1A:
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.
4KM2_B_TOPB202_1
(DIHYDROFOLATE
REDUCTASE)		 4cz1 KYNURENINE
FORMAMIDASE
(Bacillus
anthracis) 		5 / 12 ILE A 171
ASP A 151
LEU A  96
LEU A 109
ILE A 143
 None
 0.83A 4km2B-4cz1A:
undetectable		 4km2B-4cz1A:
21.82
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.
4Z2E_H_TR6H101_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT B
SYMMETRIZED E-SITE
DNA)		 4cz1 KYNURENINE
FORMAMIDASE
(Bacillus
anthracis) 		3 / 5 GLY A 139
GLY A 103
GLU A 102
 None
 0.27A 4z2eA-4cz1A:
undetectable
4z2eD-4cz1A:
undetectable		 4z2eA-4cz1A:
17.96
4z2eD-4cz1A:
20.36
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.
5DNU_A_BEZA319_0
(SHKAI2IB)		 4cz1 KYNURENINE
FORMAMIDASE
(Bacillus
anthracis) 		4 / 5 HIS A  60
ILE A  55
ILE A 171
TYR A  76
 VNJ  A 501 (-4.2A)
None
None
None
 1.00A 5dnuA-4cz1A:
undetectable		 5dnuA-4cz1A:
20.70
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.
5DNV_A_BEZA304_0
(SHKAI2IB)		 4cz1 KYNURENINE
FORMAMIDASE
(Bacillus
anthracis) 		4 / 5 HIS A  60
ILE A  55
ILE A 171
TYR A  76
 VNJ  A 501 (-4.2A)
None
None
None
 1.04A 5dnvA-4cz1A:
undetectable		 5dnvA-4cz1A:
20.70
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.
5M45_A_ACTA802_0
(ACETONE CARBOXYLASE
ALPHA SUBUNIT)		 4cz1 KYNURENINE
FORMAMIDASE
(Bacillus
anthracis) 		4 / 6 HIS A  60
ASP A  56
HIS A 161
TRP A  20
 VNJ  A 501 (-4.2A)
ZN  A 401 ( 2.5A)
ZN  A 401 (-3.4A)
VNJ  A 501 (-3.6A)
 1.29A 5m45A-4cz1A:
undetectable		 5m45A-4cz1A:
14.51
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.
5M45_D_ACTD802_0
(ACETONE CARBOXYLASE
ALPHA SUBUNIT)		 4cz1 KYNURENINE
FORMAMIDASE
(Bacillus
anthracis) 		4 / 6 HIS A  60
ASP A  56
HIS A 161
TRP A  20
 VNJ  A 501 (-4.2A)
ZN  A 401 ( 2.5A)
ZN  A 401 (-3.4A)
VNJ  A 501 (-3.6A)
 1.29A 5m45D-4cz1A:
undetectable		 5m45D-4cz1A:
14.51
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.
5M45_G_ACTG802_0
(ACETONE CARBOXYLASE
ALPHA SUBUNIT)		 4cz1 KYNURENINE
FORMAMIDASE
(Bacillus
anthracis) 		4 / 6 HIS A  60
ASP A  56
HIS A 161
TRP A  20
 VNJ  A 501 (-4.2A)
ZN  A 401 ( 2.5A)
ZN  A 401 (-3.4A)
VNJ  A 501 (-3.6A)
 1.29A 5m45G-4cz1A:
undetectable		 5m45G-4cz1A:
14.51
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.
5M45_J_ACTJ802_0
(ACETONE CARBOXYLASE
ALPHA SUBUNIT)		 4cz1 KYNURENINE
FORMAMIDASE
(Bacillus
anthracis) 		4 / 6 HIS A  60
ASP A  56
HIS A 161
TRP A  20
 VNJ  A 501 (-4.2A)
ZN  A 401 ( 2.5A)
ZN  A 401 (-3.4A)
VNJ  A 501 (-3.6A)
 1.29A 5m45J-4cz1A:
undetectable		 5m45J-4cz1A:
14.51
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.
5NCD_A_ACTA301_0
(PEPTIDOGLYCAN
N-ACETYLGLUCOSAMINE
DEACETYLASE)		 4cz1 KYNURENINE
FORMAMIDASE
(Bacillus
anthracis) 		4 / 6 ASP A  56
HIS A  60
HIS A 161
HIS A  54
 ZN  A 401 ( 2.5A)
VNJ  A 501 (-4.2A)
ZN  A 401 (-3.4A)
ZN  A 402 (-3.5A)
 0.73A 5ncdA-4cz1A:
undetectable
5ncdD-4cz1A:
undetectable		 5ncdA-4cz1A:
22.14
5ncdD-4cz1A:
22.14
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.
5NCD_C_ACTC301_0
(PEPTIDOGLYCAN
N-ACETYLGLUCOSAMINE
DEACETYLASE)		 4cz1 KYNURENINE
FORMAMIDASE
(Bacillus
anthracis) 		4 / 6 ASP A  56
HIS A  60
HIS A 161
HIS A  54
 ZN  A 401 ( 2.5A)
VNJ  A 501 (-4.2A)
ZN  A 401 (-3.4A)
ZN  A 402 (-3.5A)
 0.71A 5ncdB-4cz1A:
undetectable
5ncdC-4cz1A:
undetectable		 5ncdB-4cz1A:
22.14
5ncdC-4cz1A:
22.14
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.
5NEK_B_AZMB302_1
(PEPTIDOGLYCAN
N-ACETYLGLUCOSAMINE
DEACETYLASE)		 4cz1 KYNURENINE
FORMAMIDASE
(Bacillus
anthracis) 		4 / 8 ASP A  56
HIS A  60
HIS A 161
HIS A  54
 ZN  A 401 ( 2.5A)
VNJ  A 501 (-4.2A)
ZN  A 401 (-3.4A)
ZN  A 402 (-3.5A)
 0.84A 5nekB-4cz1A:
undetectable		 5nekB-4cz1A:
18.75
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.
5NEK_D_AZMD302_1
(PEPTIDOGLYCAN
N-ACETYLGLUCOSAMINE
DEACETYLASE)		 4cz1 KYNURENINE
FORMAMIDASE
(Bacillus
anthracis) 		4 / 8 ASP A  56
HIS A  60
HIS A 161
HIS A  54
 ZN  A 401 ( 2.5A)
VNJ  A 501 (-4.2A)
ZN  A 401 (-3.4A)
ZN  A 402 (-3.5A)
 0.81A 5nekD-4cz1A:
undetectable		 5nekD-4cz1A:
18.75
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.
5NEL_A_ACTA302_0
(PEPTIDOGLYCAN
N-ACETYLGLUCOSAMINE
DEACETYLASE)		 4cz1 KYNURENINE
FORMAMIDASE
(Bacillus
anthracis) 		4 / 6 ASP A  56
HIS A  60
HIS A 161
HIS A  54
 ZN  A 401 ( 2.5A)
VNJ  A 501 (-4.2A)
ZN  A 401 (-3.4A)
ZN  A 402 (-3.5A)
 0.75A 5nelA-4cz1A:
undetectable
5nelD-4cz1A:
undetectable		 5nelA-4cz1A:
22.14
5nelD-4cz1A:
22.14