SIMILAR PATTERN OF AMINO ACIDS MAPPED TO 'CEW'

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 (%)
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.	1DVX_B_DIFB125_1 (TRANSTHYRETIN)	3hum	PENICILLIN-BINDING PROTEIN 4 (Staphylococcus aureus)	4 / 7	LEU A 112 ALA A 142 LEU A 115 SER A 116	None None None CEW A 501 (-3.1A)	1.07A	1dvxA-3humA: undetectable	1dvxA-3humA: 12.36
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.	1GHM_A_CEDA1_1 (BETA-LACTAMASE)	3hum	PENICILLIN-BINDING PROTEIN 4 (Staphylococcus aureus)	7 / 12	ALA A 74 SER A 75 LYS A 78 SER A 139 ASN A 141 LYS A 259 GLY A 261	CEW A 501 ( 4.1A) CEW A 501 (-2.6A) None CEW A 501 (-3.4A) None CEW A 501 ( 4.4A) CEW A 501 (-3.1A)	0.63A	1ghmA-3humA: 22.2	1ghmA-3humA: 22.81
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.	1I2W_A_CFXA1300_1 (BETA-LACTAMASE)	3hum	PENICILLIN-BINDING PROTEIN 4 (Staphylococcus aureus)	7 / 12	ALA A 74 SER A 75 LYS A 78 SER A 139 ASN A 141 LYS A 259 GLY A 261	CEW A 501 ( 4.1A) CEW A 501 (-2.6A) None CEW A 501 (-3.4A) None CEW A 501 ( 4.4A) CEW A 501 (-3.1A)	0.56A	1i2wA-3humA: 22.7	1i2wA-3humA: 21.02
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.	1I2W_B_CFXB2300_1 (BETA-LACTAMASE)	3hum	PENICILLIN-BINDING PROTEIN 4 (Staphylococcus aureus)	6 / 12	ALA A 74 SER A 75 LYS A 78 SER A 139 ASN A 141 GLY A 261	CEW A 501 ( 4.1A) CEW A 501 (-2.6A) None CEW A 501 (-3.4A) None CEW A 501 (-3.1A)	0.55A	1i2wB-3humA: 22.8	1i2wB-3humA: 21.02
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.	1TT6_B_DESB128_1 (TRANSTHYRETIN)	3hum	PENICILLIN-BINDING PROTEIN 4 (Staphylococcus aureus)	4 / 5	LEU A 112 ALA A 142 LEU A 115 SER A 116	None None None CEW A 501 (-3.1A)	1.15A	1tt6B-3humA: undetectable	1tt6B-3humA: 12.56
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.	1YMX_A_CFXA1001_1 (BETA-LACTAMASE CTX-M-9)	3hum	PENICILLIN-BINDING PROTEIN 4 (Staphylococcus aureus)	7 / 12	SER A 75 LYS A 78 SER A 139 ASN A 141 LYS A 259 GLY A 261 ASP A 264	CEW A 501 (-2.6A) None CEW A 501 (-3.4A) None CEW A 501 ( 4.4A) CEW A 501 (-3.1A) None	0.91A	1ymxA-3humA: 22.5	1ymxA-3humA: 22.25
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.	1YMX_B_CFXB1002_1 (BETA-LACTAMASE CTX-M-9)	3hum	PENICILLIN-BINDING PROTEIN 4 (Staphylococcus aureus)	7 / 12	SER A 75 LYS A 78 SER A 139 ASN A 141 LYS A 259 GLY A 261 ASP A 264	CEW A 501 (-2.6A) None CEW A 501 (-3.4A) None CEW A 501 ( 4.4A) CEW A 501 (-3.1A) None	0.91A	1ymxB-3humA: 22.3	1ymxB-3humA: 22.25
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.	1YMX_B_CFXB1002_1 (BETA-LACTAMASE CTX-M-9)	3hum	PENICILLIN-BINDING PROTEIN 4 (Staphylococcus aureus)	7 / 12	SER A 75 LYS A 78 SER A 139 LYS A 259 GLY A 261 SER A 262 ASP A 264	CEW A 501 (-2.6A) None CEW A 501 (-3.4A) CEW A 501 ( 4.4A) CEW A 501 (-3.1A) CEW A 501 (-2.9A) None	0.70A	1ymxB-3humA: 22.3	1ymxB-3humA: 22.25
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.	3HUO_A_PNNA300_0 (CTX-M-9 EXTENDED-SPECTRUM BETA-LACTAMASE)	3hum	PENICILLIN-BINDING PROTEIN 4 (Staphylococcus aureus)	6 / 12	LYS A 78 ASN A 141 LYS A 259 THR A 260 GLY A 261 ASP A 264	None None CEW A 501 ( 4.4A) CEW A 501 ( 4.3A) CEW A 501 (-3.1A) None	0.95A	3huoA-3humA: 22.5	3huoA-3humA: 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.	3HUO_A_PNNA300_0 (CTX-M-9 EXTENDED-SPECTRUM BETA-LACTAMASE)	3hum	PENICILLIN-BINDING PROTEIN 4 (Staphylococcus aureus)	5 / 12	LYS A 259 THR A 260 GLY A 261 SER A 262 ASP A 264	CEW A 501 ( 4.4A) CEW A 501 ( 4.3A) CEW A 501 (-3.1A) CEW A 501 (-2.9A) None	0.64A	3huoA-3humA: 22.5	3huoA-3humA: 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.	3HUO_B_PNNB301_0 (CTX-M-9 EXTENDED-SPECTRUM BETA-LACTAMASE)	3hum	PENICILLIN-BINDING PROTEIN 4 (Staphylococcus aureus)	5 / 12	LYS A 78 ASN A 141 LYS A 259 GLY A 261 ASP A 264	None None CEW A 501 ( 4.4A) CEW A 501 (-3.1A) None	0.95A	3huoB-3humA: 22.3	3huoB-3humA: 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.	3HUO_B_PNNB301_0 (CTX-M-9 EXTENDED-SPECTRUM BETA-LACTAMASE)	3hum	PENICILLIN-BINDING PROTEIN 4 (Staphylococcus aureus)	5 / 12	LYS A 78 LYS A 259 GLY A 261 SER A 262 ASP A 264	None CEW A 501 ( 4.4A) CEW A 501 (-3.1A) CEW A 501 (-2.9A) None	0.83A	3huoB-3humA: 22.3	3huoB-3humA: 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.	3MZE_A_CFXA364_1 (D-ALANYL-D-ALANINE CARBOXYPEPTIDASE DACA)	3hum	PENICILLIN-BINDING PROTEIN 4 (Staphylococcus aureus)	6 / 12	ALA A 74 SER A 75 LYS A 78 ASN A 141 THR A 260 GLY A 261	CEW A 501 ( 4.1A) CEW A 501 (-2.6A) None None CEW A 501 ( 4.3A) CEW A 501 (-3.1A)	0.50A	3mzeA-3humA: 34.3	3mzeA-3humA: 24.84
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.	3NY4_A_SMXA308_1 (BETA-LACTAMASE)	3hum	PENICILLIN-BINDING PROTEIN 4 (Staphylococcus aureus)	6 / 12	SER A 75 SER A 139 LYS A 259 THR A 260 GLY A 261 ASP A 264	CEW A 501 (-2.6A) CEW A 501 (-3.4A) CEW A 501 ( 4.4A) CEW A 501 ( 4.3A) CEW A 501 (-3.1A) None	0.58A	3ny4A-3humA: 22.2	3ny4A-3humA: 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.	3Q07_A_WPPA300_1 (BETA-LACTAMASE)	3hum	PENICILLIN-BINDING PROTEIN 4 (Staphylococcus aureus)	6 / 12	LYS A 78 ASN A 141 LYS A 259 GLY A 261 SER A 262 ASP A 264	None None CEW A 501 ( 4.4A) CEW A 501 (-3.1A) CEW A 501 (-2.9A) None	1.01A	3q07A-3humA: 22.4	3q07A-3humA: 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.	3Q07_A_WPPA300_1 (BETA-LACTAMASE)	3hum	PENICILLIN-BINDING PROTEIN 4 (Staphylococcus aureus)	6 / 12	SER A 139 ASN A 141 LYS A 259 GLY A 261 SER A 262 ASP A 264	CEW A 501 (-3.4A) None CEW A 501 ( 4.4A) CEW A 501 (-3.1A) CEW A 501 (-2.9A) None	1.00A	3q07A-3humA: 22.4	3q07A-3humA: 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.	3Q07_B_WPPB400_1 (BETA-LACTAMASE)	3hum	PENICILLIN-BINDING PROTEIN 4 (Staphylococcus aureus)	6 / 12	LYS A 78 SER A 139 ASN A 141 LYS A 259 GLY A 261 ASP A 264	None CEW A 501 (-3.4A) None CEW A 501 ( 4.4A) CEW A 501 (-3.1A) None	0.96A	3q07B-3humA: 21.7	3q07B-3humA: 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.	3Q07_B_WPPB400_1 (BETA-LACTAMASE)	3hum	PENICILLIN-BINDING PROTEIN 4 (Staphylococcus aureus)	6 / 12	LYS A 78 SER A 139 LYS A 259 GLY A 261 SER A 262 ASP A 264	None CEW A 501 (-3.4A) CEW A 501 ( 4.4A) CEW A 501 (-3.1A) CEW A 501 (-2.9A) None	0.73A	3q07B-3humA: 21.7	3q07B-3humA: 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.	3SH8_A_CEDA1_1 (BETA-LACTAMASE)	3hum	PENICILLIN-BINDING PROTEIN 4 (Staphylococcus aureus)	6 / 12	ALA A 74 SER A 75 SER A 139 ASN A 141 LYS A 259 GLY A 261	CEW A 501 ( 4.1A) CEW A 501 (-2.6A) CEW A 501 (-3.4A) None CEW A 501 ( 4.4A) CEW A 501 (-3.1A)	0.77A	3sh8A-3humA: 23.0	3sh8A-3humA: 19.74
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.	3SH8_A_CEDA1_1 (BETA-LACTAMASE)	3hum	PENICILLIN-BINDING PROTEIN 4 (Staphylococcus aureus)	6 / 12	ALA A 74 SER A 75 SER A 139 LYS A 259 THR A 260 GLY A 261	CEW A 501 ( 4.1A) CEW A 501 (-2.6A) CEW A 501 (-3.4A) CEW A 501 ( 4.4A) CEW A 501 ( 4.3A) CEW A 501 (-3.1A)	0.40A	3sh8A-3humA: 23.0	3sh8A-3humA: 19.74
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.	3SH8_B_CEDB1_1 (BETA-LACTAMASE)	3hum	PENICILLIN-BINDING PROTEIN 4 (Staphylococcus aureus)	6 / 12	ALA A 74 SER A 75 LYS A 78 ASN A 141 GLY A 261 TYR A 291	CEW A 501 ( 4.1A) CEW A 501 (-2.6A) None None CEW A 501 (-3.1A) None	1.03A	3sh8B-3humA: 22.8	3sh8B-3humA: 19.74
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.	3SH8_B_CEDB1_1 (BETA-LACTAMASE)	3hum	PENICILLIN-BINDING PROTEIN 4 (Staphylococcus aureus)	6 / 12	ALA A 74 SER A 75 LYS A 78 ASN A 141 LYS A 259 GLY A 261	CEW A 501 ( 4.1A) CEW A 501 (-2.6A) None None CEW A 501 ( 4.4A) CEW A 501 (-3.1A)	0.77A	3sh8B-3humA: 22.8	3sh8B-3humA: 19.74
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.	3SH8_B_CEDB1_1 (BETA-LACTAMASE)	3hum	PENICILLIN-BINDING PROTEIN 4 (Staphylococcus aureus)	6 / 12	ALA A 74 SER A 75 SER A 139 LYS A 259 GLY A 261 TYR A 268	CEW A 501 ( 4.1A) CEW A 501 (-2.6A) CEW A 501 (-3.4A) CEW A 501 ( 4.4A) CEW A 501 (-3.1A) None	0.76A	3sh8B-3humA: 22.8	3sh8B-3humA: 19.74
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.	3SUE_C_SUEC1201_2 (NS3 PROTEASE, NS4A PROTEIN)	3hum	PENICILLIN-BINDING PROTEIN 4 (Staphylococcus aureus)	4 / 5	PHE A 243 TYR A 239 LEU A 258 LYS A 259	CEW A 501 (-4.6A) None None CEW A 501 ( 4.4A)	1.30A	3sueC-3humA: undetectable	3sueC-3humA: 21.64
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.	4D7B_A_TCWA1126_1 (TRANSTHYRETIN)	3hum	PENICILLIN-BINDING PROTEIN 4 (Staphylococcus aureus)	4 / 6	LEU A 112 ALA A 142 LEU A 115 SER A 116	None None None CEW A 501 (-3.1A)	1.10A	4d7bB-3humA: undetectable	4d7bB-3humA: 12.77
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.	4EUZ_A_MEMA401_1 (CARBAPENEM-HYDROLIZI NG BETA-LACTAMASE SFC-1)	3hum	PENICILLIN-BINDING PROTEIN 4 (Staphylococcus aureus)	6 / 12	LYS A 78 SER A 139 ASN A 141 LYS A 259 THR A 260 GLY A 261	None CEW A 501 (-3.4A) None CEW A 501 ( 4.4A) CEW A 501 ( 4.3A) CEW A 501 (-3.1A)	0.66A	4euzA-3humA: 22.9	4euzA-3humA: 21.94
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.	4FH2_A_0RNA303_1 (BETA-LACTAMASE SHV-1)	3hum	PENICILLIN-BINDING PROTEIN 4 (Staphylococcus aureus)	6 / 10	SER A 139 ASN A 141 LYS A 259 THR A 260 GLY A 261 ALA A 74	CEW A 501 (-3.4A) None CEW A 501 ( 4.4A) CEW A 501 ( 4.3A) CEW A 501 (-3.1A) CEW A 501 ( 4.1A)	1.41A	4fh2A-3humA: 22.9	4fh2A-3humA: 22.32
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.	4FH2_A_0RNA303_1 (BETA-LACTAMASE SHV-1)	3hum	PENICILLIN-BINDING PROTEIN 4 (Staphylococcus aureus)	5 / 10	SER A 139 LYS A 259 THR A 260 GLY A 261 ARG A 300	CEW A 501 (-3.4A) CEW A 501 ( 4.4A) CEW A 501 ( 4.3A) CEW A 501 (-3.1A) CEW A 501 ( 4.8A)	1.16A	4fh2A-3humA: 22.9	4fh2A-3humA: 22.32
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.	4N9K_A_CEDA301_1 (BETA-LACTAMASE)	3hum	PENICILLIN-BINDING PROTEIN 4 (Staphylococcus aureus)	7 / 12	ALA A 74 SER A 75 SER A 139 LYS A 259 THR A 260 GLY A 261 ARG A 300	CEW A 501 ( 4.1A) CEW A 501 (-2.6A) CEW A 501 (-3.4A) CEW A 501 ( 4.4A) CEW A 501 ( 4.3A) CEW A 501 (-3.1A) CEW A 501 ( 4.8A)	1.05A	4n9kA-3humA: 22.8	4n9kA-3humA: 20.61
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.	4N9K_B_CEDB301_1 (BETA-LACTAMASE)	3hum	PENICILLIN-BINDING PROTEIN 4 (Staphylococcus aureus)	7 / 12	ALA A 74 SER A 75 SER A 139 LYS A 259 THR A 260 GLY A 261 ARG A 300	CEW A 501 ( 4.1A) CEW A 501 (-2.6A) CEW A 501 (-3.4A) CEW A 501 ( 4.4A) CEW A 501 ( 4.3A) CEW A 501 (-3.1A) CEW A 501 ( 4.8A)	1.04A	4n9kB-3humA: 22.9	4n9kB-3humA: 20.61
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.	4N9K_B_CEDB301_1 (BETA-LACTAMASE)	3hum	PENICILLIN-BINDING PROTEIN 4 (Staphylococcus aureus)	7 / 12	ALA A 74 SER A 75 SER A 139 LYS A 259 THR A 260 GLY A 261 TYR A 268	CEW A 501 ( 4.1A) CEW A 501 (-2.6A) CEW A 501 (-3.4A) CEW A 501 ( 4.4A) CEW A 501 ( 4.3A) CEW A 501 (-3.1A) None	0.69A	4n9kB-3humA: 22.9	4n9kB-3humA: 20.61
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.	5A6I_A_TCWA1124_1 (TRANSTHYRETIN)	3hum	PENICILLIN-BINDING PROTEIN 4 (Staphylococcus aureus)	4 / 6	LEU A 112 ALA A 142 LEU A 115 SER A 116	None None None CEW A 501 (-3.1A)	1.06A	5a6iA-3humA: undetectable	5a6iA-3humA: 12.09
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.	5GHY_A_CEDA301_1 (BETA-LACTAMASE)	3hum	PENICILLIN-BINDING PROTEIN 4 (Staphylococcus aureus)	6 / 12	ALA A 74 SER A 75 ASN A 141 LYS A 259 GLY A 261 TYR A 291	CEW A 501 ( 4.1A) CEW A 501 (-2.6A) None CEW A 501 ( 4.4A) CEW A 501 (-3.1A) None	1.07A	5ghyA-3humA: 22.5	5ghyA-3humA: 20.61
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.	5GHY_A_CEDA301_1 (BETA-LACTAMASE)	3hum	PENICILLIN-BINDING PROTEIN 4 (Staphylococcus aureus)	6 / 12	ALA A 74 SER A 75 SER A 139 LYS A 259 GLY A 261 TYR A 268	CEW A 501 ( 4.1A) CEW A 501 (-2.6A) CEW A 501 (-3.4A) CEW A 501 ( 4.4A) CEW A 501 (-3.1A) None	0.74A	5ghyA-3humA: 22.5	5ghyA-3humA: 20.61
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.	5GHY_A_CEDA301_1 (BETA-LACTAMASE)	3hum	PENICILLIN-BINDING PROTEIN 4 (Staphylococcus aureus)	6 / 12	ALA A 74 SER A 75 SER A 139 LYS A 259 GLY A 261 TYR A 291	CEW A 501 ( 4.1A) CEW A 501 (-2.6A) CEW A 501 (-3.4A) CEW A 501 ( 4.4A) CEW A 501 (-3.1A) None	1.07A	5ghyA-3humA: 22.5	5ghyA-3humA: 20.61
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.	5GHY_B_CEDB301_1 (BETA-LACTAMASE)	3hum	PENICILLIN-BINDING PROTEIN 4 (Staphylococcus aureus)	6 / 12	ALA A 74 SER A 75 SER A 139 LYS A 259 GLY A 261 TYR A 268	CEW A 501 ( 4.1A) CEW A 501 (-2.6A) CEW A 501 (-3.4A) CEW A 501 ( 4.4A) CEW A 501 (-3.1A) None	0.73A	5ghyB-3humA: 22.6	5ghyB-3humA: 20.61
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.	5GHZ_A_CEDA301_1 (BETA-LACTAMASE)	3hum	PENICILLIN-BINDING PROTEIN 4 (Staphylococcus aureus)	7 / 11	ALA A 74 SER A 75 SER A 139 LYS A 259 THR A 260 GLY A 261 ARG A 300	CEW A 501 ( 4.1A) CEW A 501 (-2.6A) CEW A 501 (-3.4A) CEW A 501 ( 4.4A) CEW A 501 ( 4.3A) CEW A 501 (-3.1A) CEW A 501 ( 4.8A)	1.04A	5ghzA-3humA: 22.6	5ghzA-3humA: 20.61
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.	5GHZ_B_CEDB301_1 (BETA-LACTAMASE)	3hum	PENICILLIN-BINDING PROTEIN 4 (Staphylococcus aureus)	7 / 10	ALA A 74 SER A 75 SER A 139 LYS A 259 THR A 260 GLY A 261 ARG A 300	CEW A 501 ( 4.1A) CEW A 501 (-2.6A) CEW A 501 (-3.4A) CEW A 501 ( 4.4A) CEW A 501 ( 4.3A) CEW A 501 (-3.1A) CEW A 501 ( 4.8A)	1.05A	5ghzB-3humA: 22.6	5ghzB-3humA: 20.61
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.	5L4I_B_6J3B201_0 (TRANSTHYRETIN)	3hum	PENICILLIN-BINDING PROTEIN 4 (Staphylococcus aureus)	4 / 6	LEU A 112 ALA A 142 LEU A 115 SER A 116	None None None CEW A 501 (-3.1A)	1.12A	5l4iB-3humA: undetectable	5l4iB-3humA: 12.56
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.	5U6M_B_SALB503_1 (UDP-GLYCOSYLTRANSFER ASE 74F2)	3hum	PENICILLIN-BINDING PROTEIN 4 (Staphylococcus aureus)	4 / 7	THR A 260 HIS A 270 MET A 250 THR A 255	CEW A 501 ( 4.3A) None None None	1.37A	5u6mB-3humA: undetectable	5u6mB-3humA: 22.35
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.	5X24_A_LSNA503_1 (CYTOCHROME P450 2C9)	3hum	PENICILLIN-BINDING PROTEIN 4 (Staphylococcus aureus)	4 / 6	PHE A 241 GLY A 261 THR A 260 ASN A 269	CEW A 501 (-4.1A) CEW A 501 (-3.1A) CEW A 501 ( 4.3A) None	1.01A	5x24A-3humA: undetectable	5x24A-3humA: 21.77
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.	6B5Y_B_9F2B400_1 (BETA-LACTAMASE)	3hum	PENICILLIN-BINDING PROTEIN 4 (Staphylococcus aureus)	6 / 12	SER A 75 SER A 139 LYS A 259 THR A 260 GLY A 261 ASP A 264	CEW A 501 (-2.6A) CEW A 501 (-3.4A) CEW A 501 ( 4.4A) CEW A 501 ( 4.3A) CEW A 501 (-3.1A) None	0.58A	6b5yB-3humA: 22.5	6b5yB-3humA: 11.70
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.	6B5Y_D_9F2D400_1 (BETA-LACTAMASE)	3hum	PENICILLIN-BINDING PROTEIN 4 (Staphylococcus aureus)	7 / 12	SER A 75 SER A 139 LYS A 259 THR A 260 GLY A 261 ASP A 264 GLU A 297	CEW A 501 (-2.6A) CEW A 501 (-3.4A) CEW A 501 ( 4.4A) CEW A 501 ( 4.3A) CEW A 501 (-3.1A) None CEW A 501 (-3.2A)	0.74A	6b5yD-3humA: 22.6	6b5yD-3humA: 11.70
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.	6B68_B_9F2B301_1 (BETA-LACTAMASE)	3hum	PENICILLIN-BINDING PROTEIN 4 (Staphylococcus aureus)	6 / 12	SER A 75 SER A 139 LYS A 259 THR A 260 GLY A 261 ASP A 264	CEW A 501 (-2.6A) CEW A 501 (-3.4A) CEW A 501 ( 4.4A) CEW A 501 ( 4.3A) CEW A 501 (-3.1A) None	0.55A	6b68B-3humA: 22.7	6b68B-3humA: 11.70
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.	6B68_D_9F2D400_1 (BETA-LACTAMASE)	3hum	PENICILLIN-BINDING PROTEIN 4 (Staphylococcus aureus)	6 / 12	SER A 75 SER A 139 LYS A 259 GLY A 261 ASP A 264 GLU A 297	CEW A 501 (-2.6A) CEW A 501 (-3.4A) CEW A 501 ( 4.4A) CEW A 501 (-3.1A) None CEW A 501 (-3.2A)	0.72A	6b68D-3humA: 22.5	6b68D-3humA: 11.70
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.	6B69_B_9F2B301_1 (BETA-LACTAMASE)	3hum	PENICILLIN-BINDING PROTEIN 4 (Staphylococcus aureus)	6 / 12	SER A 75 SER A 139 LYS A 259 THR A 260 GLY A 261 ASP A 264	CEW A 501 (-2.6A) CEW A 501 (-3.4A) CEW A 501 ( 4.4A) CEW A 501 ( 4.3A) CEW A 501 (-3.1A) None	0.61A	6b69A-3humA: 22.4 6b69B-3humA: 22.5	6b69A-3humA: 11.70 6b69B-3humA: 11.70
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.	6B69_D_9F2D301_1 (BETA-LACTAMASE)	3hum	PENICILLIN-BINDING PROTEIN 4 (Staphylococcus aureus)	7 / 12	SER A 75 SER A 139 ARG A 300 LYS A 259 THR A 260 GLY A 261 GLU A 297	CEW A 501 (-2.6A) CEW A 501 (-3.4A) CEW A 501 ( 4.8A) CEW A 501 ( 4.4A) CEW A 501 ( 4.3A) CEW A 501 (-3.1A) CEW A 501 (-3.2A)	1.22A	6b69D-3humA: 22.4	6b69D-3humA: 11.70
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.	6B6A_B_9F2B301_1 (BETA-LACTAMASE)	3hum	PENICILLIN-BINDING PROTEIN 4 (Staphylococcus aureus)	6 / 12	SER A 75 SER A 139 LYS A 259 THR A 260 GLY A 261 ASP A 264	CEW A 501 (-2.6A) CEW A 501 (-3.4A) CEW A 501 ( 4.4A) CEW A 501 ( 4.3A) CEW A 501 (-3.1A) None	0.59A	6b6aB-3humA: 22.6	6b6aB-3humA: 11.70
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.	6B6A_D_9F2D301_1 (BETA-LACTAMASE)	3hum	PENICILLIN-BINDING PROTEIN 4 (Staphylococcus aureus)	6 / 12	SER A 75 ARG A 300 LYS A 259 THR A 260 GLY A 261 GLU A 297	CEW A 501 (-2.6A) CEW A 501 ( 4.8A) CEW A 501 ( 4.4A) CEW A 501 ( 4.3A) CEW A 501 (-3.1A) CEW A 501 (-3.2A)	1.27A	6b6aD-3humA: 22.6	6b6aD-3humA: 11.70
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.	6B6A_D_9F2D301_1 (BETA-LACTAMASE)	3hum	PENICILLIN-BINDING PROTEIN 4 (Staphylococcus aureus)	7 / 12	SER A 75 SER A 139 LYS A 259 THR A 260 GLY A 261 ASP A 264 GLU A 297	CEW A 501 (-2.6A) CEW A 501 (-3.4A) CEW A 501 ( 4.4A) CEW A 501 ( 4.3A) CEW A 501 (-3.1A) None CEW A 501 (-3.2A)	0.74A	6b6aD-3humA: 22.6	6b6aD-3humA: 11.70
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.	6B6C_A_9F2A301_1 (BETA-LACTAMASE)	3hum	PENICILLIN-BINDING PROTEIN 4 (Staphylococcus aureus)	6 / 12	SER A 75 ARG A 186 ARG A 300 LYS A 259 THR A 260 GLY A 261	CEW A 501 (-2.6A) None CEW A 501 ( 4.8A) CEW A 501 ( 4.4A) CEW A 501 ( 4.3A) CEW A 501 (-3.1A)	1.39A	6b6cA-3humA: 22.6	6b6cA-3humA: 11.70
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.	6B6C_A_9F2A301_1 (BETA-LACTAMASE)	3hum	PENICILLIN-BINDING PROTEIN 4 (Staphylococcus aureus)	5 / 12	SER A 75 SER A 139 LYS A 259 THR A 260 GLY A 261	CEW A 501 (-2.6A) CEW A 501 (-3.4A) CEW A 501 ( 4.4A) CEW A 501 ( 4.3A) CEW A 501 (-3.1A)	0.40A	6b6cA-3humA: 22.6	6b6cA-3humA: 11.70
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.	6B6F_A_9F2A301_1 (BETA-LACTAMASE)	3hum	PENICILLIN-BINDING PROTEIN 4 (Staphylococcus aureus)	6 / 12	SER A 75 SER A 139 LYS A 259 THR A 260 GLY A 261 ASP A 264	CEW A 501 (-2.6A) CEW A 501 (-3.4A) CEW A 501 ( 4.4A) CEW A 501 ( 4.3A) CEW A 501 (-3.1A) None	0.64A	6b6fA-3humA: 22.5	6b6fA-3humA: 11.70

[["DrReposER ID","Desc.","Hit PDB","Hit molecule","Hit organism","Res. no.","Interface","HETATM","RMSD","Z-score","Seq ID"],["1DVX_B_DIFB125_1","TRANSTHYRETIN;TRANSTHYRETIN","3hum","PENICILLIN-BINDING PROTEIN 4","Staphylococcus aureus",4,"LEU A 112;ALA A 142;LEU A 115;SER A 116","None;None;None;CEW A 501 (-3.1A)","1.07A","1dvxA-3humA:undetectable",null],["1GHM_A_CEDA1_1","BETA-LACTAMASE","3hum","PENICILLIN-BINDING PROTEIN 4","Staphylococcus aureus",7,"ALA A  74;SER A  75;LYS A  78;SER A 139;ASN A 141;LYS A 259;GLY A 261","CEW A 501 ( 4.1A);CEW A 501 (-2.6A);None;CEW A 501 (-3.4A);None;CEW A 501 ( 4.4A);CEW A 501 (-3.1A)","0.63A","1ghmA-3humA:22.2","1dvxA-3humA:12.36"],["1I2W_A_CFXA1300_1","BETA-LACTAMASE","3hum","PENICILLIN-BINDING PROTEIN 4","Staphylococcus aureus",7,"ALA A  74;SER A  75;LYS A  78;SER A 139;ASN A 141;LYS A 259;GLY A 261","CEW A 501 ( 4.1A);CEW A 501 (-2.6A);None;CEW A 501 (-3.4A);None;CEW A 501 ( 4.4A);CEW A 501 (-3.1A)","0.56A","1i2wA-3humA:22.7","1ghmA-3humA:22.81"],["1I2W_B_CFXB2300_1","BETA-LACTAMASE","3hum","PENICILLIN-BINDING PROTEIN 4","Staphylococcus aureus",6,"ALA A  74;SER A  75;LYS A  78;SER A 139;ASN A 141;GLY A 261","CEW A 501 ( 4.1A);CEW A 501 (-2.6A);None;CEW A 501 (-3.4A);None;CEW A 501 (-3.1A)","0.55A","1i2wB-3humA:22.8","1i2wA-3humA:21.02"],["1TT6_B_DESB128_1","TRANSTHYRETIN","3hum","PENICILLIN-BINDING PROTEIN 4","Staphylococcus aureus",4,"LEU A 112;ALA A 142;LEU A 115;SER A 116","None;None;None;CEW A 501 (-3.1A)","1.15A","1tt6B-3humA:undetectable","1i2wB-3humA:21.02"],["1YMX_A_CFXA1001_1","BETA-LACTAMASE CTX-M-9","3hum","PENICILLIN-BINDING PROTEIN 4","Staphylococcus aureus",7,"SER A  75;LYS A  78;SER A 139;ASN A 141;LYS A 259;GLY A 261;ASP A 264","CEW A 501 (-2.6A);None;CEW A 501 (-3.4A);None;CEW A 501 ( 4.4A);CEW A 501 (-3.1A);None","0.91A","1ymxA-3humA:22.5","1tt6B-3humA:12.56"],["1YMX_B_CFXB1002_1","BETA-LACTAMASE CTX-M-9","3hum","PENICILLIN-BINDING PROTEIN 4","Staphylococcus aureus",7,"SER A  75;LYS A  78;SER A 139;ASN A 141;LYS A 259;GLY A 261;ASP A 264","CEW A 501 (-2.6A);None;CEW A 501 (-3.4A);None;CEW A 501 ( 4.4A);CEW A 501 (-3.1A);None","0.91A","1ymxB-3humA:22.3","1ymxA-3humA:22.25"],["1YMX_B_CFXB1002_1","BETA-LACTAMASE CTX-M-9","3hum","PENICILLIN-BINDING PROTEIN 4","Staphylococcus aureus",7,"SER A  75;LYS A  78;SER A 139;LYS A 259;GLY A 261;SER A 262;ASP A 264","CEW A 501 (-2.6A);None;CEW A 501 (-3.4A);CEW A 501 ( 4.4A);CEW A 501 (-3.1A);CEW A 501 (-2.9A);None","0.70A","1ymxB-3humA:22.3","1ymxB-3humA:22.25"],["3HUO_A_PNNA300_0","CTX-M-9 EXTENDED-SPECTRUM BETA-LACTAMASE","3hum","PENICILLIN-BINDING PROTEIN 4","Staphylococcus aureus",6,"LYS A  78;ASN A 141;LYS A 259;THR A 260;GLY A 261;ASP A 264","None;None;CEW A 501 ( 4.4A);CEW A 501 ( 4.3A);CEW A 501 (-3.1A);None","0.95A","3huoA-3humA:22.5","1ymxB-3humA:22.25"],["3HUO_A_PNNA300_0","CTX-M-9 EXTENDED-SPECTRUM BETA-LACTAMASE","3hum","PENICILLIN-BINDING PROTEIN 4","Staphylococcus aureus",5,"LYS A 259;THR A 260;GLY A 261;SER A 262;ASP A 264","CEW A 501 ( 4.4A);CEW A 501 ( 4.3A);CEW A 501 (-3.1A);CEW A 501 (-2.9A);None","0.64A","3huoA-3humA:22.5","3huoA-3humA:22.05"],["3HUO_B_PNNB301_0","CTX-M-9 EXTENDED-SPECTRUM BETA-LACTAMASE","3hum","PENICILLIN-BINDING PROTEIN 4","Staphylococcus aureus",5,"LYS A  78;ASN A 141;LYS A 259;GLY A 261;ASP A 264","None;None;CEW A 501 ( 4.4A);CEW A 501 (-3.1A);None","0.95A","3huoB-3humA:22.3","3huoA-3humA:22.05"],["3HUO_B_PNNB301_0","CTX-M-9 EXTENDED-SPECTRUM BETA-LACTAMASE","3hum","PENICILLIN-BINDING PROTEIN 4","Staphylococcus aureus",5,"LYS A  78;LYS A 259;GLY A 261;SER A 262;ASP A 264","None;CEW A 501 ( 4.4A);CEW A 501 (-3.1A);CEW A 501 (-2.9A);None","0.83A","3huoB-3humA:22.3","3huoB-3humA:22.05"],["3MZE_A_CFXA364_1","D-ALANYL-D-ALANINE CARBOXYPEPTIDASE DACA","3hum","PENICILLIN-BINDING PROTEIN 4","Staphylococcus aureus",6,"ALA A  74;SER A  75;LYS A  78;ASN A 141;THR A 260;GLY A 261","CEW A 501 ( 4.1A);CEW A 501 (-2.6A);None;None;CEW A 501 ( 4.3A);CEW A 501 (-3.1A)","0.50A","3mzeA-3humA:34.3","3huoB-3humA:22.05"],["3NY4_A_SMXA308_1","BETA-LACTAMASE","3hum","PENICILLIN-BINDING PROTEIN 4","Staphylococcus aureus",6,"SER A  75;SER A 139;LYS A 259;THR A 260;GLY A 261;ASP A 264","CEW A 501 (-2.6A);CEW A 501 (-3.4A);CEW A 501 ( 4.4A);CEW A 501 ( 4.3A);CEW A 501 (-3.1A);None","0.58A","3ny4A-3humA:22.2","3mzeA-3humA:24.84"],["3Q07_A_WPPA300_1","BETA-LACTAMASE","3hum","PENICILLIN-BINDING PROTEIN 4","Staphylococcus aureus",6,"LYS A  78;ASN A 141;LYS A 259;GLY A 261;SER A 262;ASP A 264","None;None;CEW A 501 ( 4.4A);CEW A 501 (-3.1A);CEW A 501 (-2.9A);None","1.01A","3q07A-3humA:22.4","3ny4A-3humA:20.70"],["3Q07_A_WPPA300_1","BETA-LACTAMASE","3hum","PENICILLIN-BINDING PROTEIN 4","Staphylococcus aureus",6,"SER A 139;ASN A 141;LYS A 259;GLY A 261;SER A 262;ASP A 264","CEW A 501 (-3.4A);None;CEW A 501 ( 4.4A);CEW A 501 (-3.1A);CEW A 501 (-2.9A);None","1.00A","3q07A-3humA:22.4","3q07A-3humA:22.05"],["3Q07_B_WPPB400_1","BETA-LACTAMASE","3hum","PENICILLIN-BINDING PROTEIN 4","Staphylococcus aureus",6,"LYS A  78;SER A 139;ASN A 141;LYS A 259;GLY A 261;ASP A 264","None;CEW A 501 (-3.4A);None;CEW A 501 ( 4.4A);CEW A 501 (-3.1A);None","0.96A","3q07B-3humA:21.7","3q07A-3humA:22.05"],["3Q07_B_WPPB400_1","BETA-LACTAMASE","3hum","PENICILLIN-BINDING PROTEIN 4","Staphylococcus aureus",6,"LYS A  78;SER A 139;LYS A 259;GLY A 261;SER A 262;ASP A 264","None;CEW A 501 (-3.4A);CEW A 501 ( 4.4A);CEW A 501 (-3.1A);CEW A 501 (-2.9A);None","0.73A","3q07B-3humA:21.7","3q07B-3humA:22.05"],["3SH8_A_CEDA1_1","BETA-LACTAMASE","3hum","PENICILLIN-BINDING PROTEIN 4","Staphylococcus aureus",6,"ALA A  74;SER A  75;SER A 139;ASN A 141;LYS A 259;GLY A 261","CEW A 501 ( 4.1A);CEW A 501 (-2.6A);CEW A 501 (-3.4A);None;CEW A 501 ( 4.4A);CEW A 501 (-3.1A)","0.77A","3sh8A-3humA:23.0","3q07B-3humA:22.05"],["3SH8_A_CEDA1_1","BETA-LACTAMASE","3hum","PENICILLIN-BINDING PROTEIN 4","Staphylococcus aureus",6,"ALA A  74;SER A  75;SER A 139;LYS A 259;THR A 260;GLY A 261","CEW A 501 ( 4.1A);CEW A 501 (-2.6A);CEW A 501 (-3.4A);CEW A 501 ( 4.4A);CEW A 501 ( 4.3A);CEW A 501 (-3.1A)","0.40A","3sh8A-3humA:23.0","3sh8A-3humA:19.74"],["3SH8_B_CEDB1_1","BETA-LACTAMASE","3hum","PENICILLIN-BINDING PROTEIN 4","Staphylococcus aureus",6,"ALA A  74;SER A  75;LYS A  78;ASN A 141;GLY A 261;TYR A 291","CEW A 501 ( 4.1A);CEW A 501 (-2.6A);None;None;CEW A 501 (-3.1A);None","1.03A","3sh8B-3humA:22.8","3sh8A-3humA:19.74"],["3SH8_B_CEDB1_1","BETA-LACTAMASE","3hum","PENICILLIN-BINDING PROTEIN 4","Staphylococcus aureus",6,"ALA A  74;SER A  75;LYS A  78;ASN A 141;LYS A 259;GLY A 261","CEW A 501 ( 4.1A);CEW A 501 (-2.6A);None;None;CEW A 501 ( 4.4A);CEW A 501 (-3.1A)","0.77A","3sh8B-3humA:22.8","3sh8B-3humA:19.74"],["3SH8_B_CEDB1_1","BETA-LACTAMASE","3hum","PENICILLIN-BINDING PROTEIN 4","Staphylococcus aureus",6,"ALA A  74;SER A  75;SER A 139;LYS A 259;GLY A 261;TYR A 268","CEW A 501 ( 4.1A);CEW A 501 (-2.6A);CEW A 501 (-3.4A);CEW A 501 ( 4.4A);CEW A 501 (-3.1A);None","0.76A","3sh8B-3humA:22.8","3sh8B-3humA:19.74"],["3SUE_C_SUEC1201_2","NS3 PROTEASE, NS4A PROTEIN","3hum","PENICILLIN-BINDING PROTEIN 4","Staphylococcus aureus",4,"PHE A 243;TYR A 239;LEU A 258;LYS A 259","CEW A 501 (-4.6A);None;None;CEW A 501 ( 4.4A)","1.30A","3sueC-3humA:undetectable","3sh8B-3humA:19.74"],["4D7B_A_TCWA1126_1","TRANSTHYRETIN;TRANSTHYRETIN","3hum","PENICILLIN-BINDING PROTEIN 4","Staphylococcus aureus",4,"LEU A 112;ALA A 142;LEU A 115;SER A 116","None;None;None;CEW A 501 (-3.1A)","1.10A","4d7bB-3humA:undetectable","3sueC-3humA:21.64"],["4EUZ_A_MEMA401_1","CARBAPENEM-HYDROLIZING BETA-LACTAMASE SFC-1","3hum","PENICILLIN-BINDING PROTEIN 4","Staphylococcus aureus",6,"LYS A  78;SER A 139;ASN A 141;LYS A 259;THR A 260;GLY A 261","None;CEW A 501 (-3.4A);None;CEW A 501 ( 4.4A);CEW A 501 ( 4.3A);CEW A 501 (-3.1A)","0.66A","4euzA-3humA:22.9","4d7bB-3humA:12.77"],["4FH2_A_0RNA303_1","BETA-LACTAMASE SHV-1","3hum","PENICILLIN-BINDING PROTEIN 4","Staphylococcus aureus",6,"SER A 139;ASN A 141;LYS A 259;THR A 260;GLY A 261;ALA A  74","CEW A 501 (-3.4A);None;CEW A 501 ( 4.4A);CEW A 501 ( 4.3A);CEW A 501 (-3.1A);CEW A 501 ( 4.1A)","1.41A","4fh2A-3humA:22.9","4euzA-3humA:21.94"],["4FH2_A_0RNA303_1","BETA-LACTAMASE SHV-1","3hum","PENICILLIN-BINDING PROTEIN 4","Staphylococcus aureus",5,"SER A 139;LYS A 259;THR A 260;GLY A 261;ARG A 300","CEW A 501 (-3.4A);CEW A 501 ( 4.4A);CEW A 501 ( 4.3A);CEW A 501 (-3.1A);CEW A 501 ( 4.8A)","1.16A","4fh2A-3humA:22.9","4fh2A-3humA:22.32"],["4N9K_A_CEDA301_1","BETA-LACTAMASE","3hum","PENICILLIN-BINDING PROTEIN 4","Staphylococcus aureus",7,"ALA A  74;SER A  75;SER A 139;LYS A 259;THR A 260;GLY A 261;ARG A 300","CEW A 501 ( 4.1A);CEW A 501 (-2.6A);CEW A 501 (-3.4A);CEW A 501 ( 4.4A);CEW A 501 ( 4.3A);CEW A 501 (-3.1A);CEW A 501 ( 4.8A)","1.05A","4n9kA-3humA:22.8","4fh2A-3humA:22.32"],["4N9K_B_CEDB301_1","BETA-LACTAMASE","3hum","PENICILLIN-BINDING PROTEIN 4","Staphylococcus aureus",7,"ALA A  74;SER A  75;SER A 139;LYS A 259;THR A 260;GLY A 261;ARG A 300","CEW A 501 ( 4.1A);CEW A 501 (-2.6A);CEW A 501 (-3.4A);CEW A 501 ( 4.4A);CEW A 501 ( 4.3A);CEW A 501 (-3.1A);CEW A 501 ( 4.8A)","1.04A","4n9kB-3humA:22.9","4n9kA-3humA:20.61"],["4N9K_B_CEDB301_1","BETA-LACTAMASE","3hum","PENICILLIN-BINDING PROTEIN 4","Staphylococcus aureus",7,"ALA A  74;SER A  75;SER A 139;LYS A 259;THR A 260;GLY A 261;TYR A 268","CEW A 501 ( 4.1A);CEW A 501 (-2.6A);CEW A 501 (-3.4A);CEW A 501 ( 4.4A);CEW A 501 ( 4.3A);CEW A 501 (-3.1A);None","0.69A","4n9kB-3humA:22.9","4n9kB-3humA:20.61"],["5A6I_A_TCWA1124_1","TRANSTHYRETIN","3hum","PENICILLIN-BINDING PROTEIN 4","Staphylococcus aureus",4,"LEU A 112;ALA A 142;LEU A 115;SER A 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(-3.1A);CEW A 501 ( 4.8A)","1.05A","5ghzB-3humA:22.6","5ghzA-3humA:20.61"],["5L4I_B_6J3B201_0","TRANSTHYRETIN","3hum","PENICILLIN-BINDING PROTEIN 4","Staphylococcus aureus",4,"LEU A 112;ALA A 142;LEU A 115;SER A 116","None;None;None;CEW A 501 (-3.1A)","1.12A","5l4iB-3humA:undetectable","5ghzB-3humA:20.61"],["5U6M_B_SALB503_1","UDP-GLYCOSYLTRANSFERASE 74F2","3hum","PENICILLIN-BINDING PROTEIN 4","Staphylococcus aureus",4,"THR A 260;HIS A 270;MET A 250;THR A 255","CEW A 501 ( 4.3A);None;None;None","1.37A","5u6mB-3humA:undetectable","5l4iB-3humA:12.56"],["5X24_A_LSNA503_1","CYTOCHROME P450 2C9","3hum","PENICILLIN-BINDING PROTEIN 4","Staphylococcus aureus",4,"PHE A 241;GLY A 261;THR A 260;ASN A 269","CEW A 501 (-4.1A);CEW A 501 (-3.1A);CEW A 501 ( 4.3A);None","1.01A","5x24A-3humA:undetectable","5u6mB-3humA:22.35"],["6B5Y_B_9F2B400_1","BETA-LACTAMASE","3hum","PENICILLIN-BINDING PROTEIN 4","Staphylococcus aureus",6,"SER A  75;SER A 139;LYS A 259;THR A 260;GLY A 261;ASP A 264","CEW A 501 (-2.6A);CEW A 501 (-3.4A);CEW A 501 ( 4.4A);CEW A 501 ( 4.3A);CEW A 501 (-3.1A);None","0.58A","6b5yB-3humA:22.5","5x24A-3humA:21.77"],["6B5Y_D_9F2D400_1","BETA-LACTAMASE","3hum","PENICILLIN-BINDING PROTEIN 4","Staphylococcus aureus",7,"SER A  75;SER A 139;LYS A 259;THR A 260;GLY A 261;ASP A 264;GLU A 297","CEW A 501 (-2.6A);CEW A 501 (-3.4A);CEW A 501 ( 4.4A);CEW A 501 ( 4.3A);CEW A 501 (-3.1A);None;CEW A 501 (-3.2A)","0.74A","6b5yD-3humA:22.6","6b5yB-3humA:11.70"],["6B68_B_9F2B301_1","BETA-LACTAMASE","3hum","PENICILLIN-BINDING PROTEIN 4","Staphylococcus aureus",6,"SER A  75;SER A 139;LYS A 259;THR A 260;GLY A 261;ASP A 264","CEW A 501 (-2.6A);CEW A 501 (-3.4A);CEW A 501 ( 4.4A);CEW A 501 ( 4.3A);CEW A 501 (-3.1A);None","0.55A","6b68B-3humA:22.7","6b5yD-3humA:11.70"],["6B68_D_9F2D400_1","BETA-LACTAMASE","3hum","PENICILLIN-BINDING PROTEIN 4","Staphylococcus aureus",6,"SER A  75;SER A 139;LYS A 259;GLY A 261;ASP A 264;GLU A 297","CEW A 501 (-2.6A);CEW A 501 (-3.4A);CEW A 501 ( 4.4A);CEW A 501 (-3.1A);None;CEW A 501 (-3.2A)","0.72A","6b68D-3humA:22.5","6b68B-3humA:11.70"],["6B69_B_9F2B301_1","BETA-LACTAMASE;BETA-LACTAMASE","3hum","PENICILLIN-BINDING PROTEIN 4","Staphylococcus aureus",6,"SER A  75;SER A 139;LYS A 259;THR A 260;GLY A 261;ASP A 264","CEW A 501 (-2.6A);CEW A 501 (-3.4A);CEW A 501 ( 4.4A);CEW A 501 ( 4.3A);CEW A 501 (-3.1A);None","0.61A","6b69A-3humA:22.4;6b69B-3humA:22.5","6b68D-3humA:11.70"],["6B69_D_9F2D301_1","BETA-LACTAMASE","3hum","PENICILLIN-BINDING PROTEIN 4","Staphylococcus aureus",7,"SER A  75;SER A 139;ARG A 300;LYS A 259;THR A 260;GLY A 261;GLU A 297","CEW A 501 (-2.6A);CEW A 501 (-3.4A);CEW A 501 ( 4.8A);CEW A 501 ( 4.4A);CEW A 501 ( 4.3A);CEW A 501 (-3.1A);CEW A 501 (-3.2A)","1.22A","6b69D-3humA:22.4","6b69A-3humA:11.70;6b69B-3humA:11.70"],["6B6A_B_9F2B301_1","BETA-LACTAMASE","3hum","PENICILLIN-BINDING PROTEIN 4","Staphylococcus aureus",6,"SER A  75;SER A 139;LYS A 259;THR A 260;GLY A 261;ASP A 264","CEW A 501 (-2.6A);CEW A 501 (-3.4A);CEW A 501 ( 4.4A);CEW A 501 ( 4.3A);CEW A 501 (-3.1A);None","0.59A","6b6aB-3humA:22.6","6b69D-3humA:11.70"],["6B6A_D_9F2D301_1","BETA-LACTAMASE","3hum","PENICILLIN-BINDING PROTEIN 4","Staphylococcus aureus",6,"SER A  75;ARG A 300;LYS A 259;THR A 260;GLY A 261;GLU A 297","CEW A 501 (-2.6A);CEW A 501 ( 4.8A);CEW A 501 ( 4.4A);CEW A 501 ( 4.3A);CEW A 501 (-3.1A);CEW A 501 (-3.2A)","1.27A","6b6aD-3humA:22.6","6b6aB-3humA:11.70"],["6B6A_D_9F2D301_1","BETA-LACTAMASE","3hum","PENICILLIN-BINDING PROTEIN 4","Staphylococcus aureus",7,"SER A  75;SER A 139;LYS A 259;THR A 260;GLY A 261;ASP A 264;GLU A 297","CEW A 501 (-2.6A);CEW A 501 (-3.4A);CEW A 501 ( 4.4A);CEW A 501 ( 4.3A);CEW A 501 (-3.1A);None;CEW A 501 (-3.2A)","0.74A","6b6aD-3humA:22.6","6b6aD-3humA:11.70"],["6B6C_A_9F2A301_1","BETA-LACTAMASE","3hum","PENICILLIN-BINDING PROTEIN 4","Staphylococcus aureus",6,"SER A  75;ARG A 186;ARG A 300;LYS A 259;THR A 260;GLY A 261","CEW A 501 (-2.6A);None;CEW A 501 ( 4.8A);CEW A 501 ( 4.4A);CEW A 501 ( 4.3A);CEW A 501 (-3.1A)","1.39A","6b6cA-3humA:22.6","6b6aD-3humA:11.70"],["6B6C_A_9F2A301_1","BETA-LACTAMASE","3hum","PENICILLIN-BINDING PROTEIN 4","Staphylococcus aureus",5,"SER A  75;SER A 139;LYS A 259;THR A 260;GLY A 261","CEW A 501 (-2.6A);CEW A 501 (-3.4A);CEW A 501 ( 4.4A);CEW A 501 ( 4.3A);CEW A 501 (-3.1A)","0.40A","6b6cA-3humA:22.6","6b6cA-3humA:11.70"],["6B6F_A_9F2A301_1","BETA-LACTAMASE","3hum","PENICILLIN-BINDING PROTEIN 4","Staphylococcus aureus",6,"SER A  75;SER A 139;LYS A 259;THR A 260;GLY A 261;ASP A 264","CEW A 501 (-2.6A);CEW A 501 (-3.4A);CEW A 501 ( 4.4A);CEW A 501 ( 4.3A);CEW A 501 (-3.1A);None","0.64A","6b6fA-3humA:22.5","6b6cA-3humA:11.70"]]