6NMN

Ternary complex structure of the T130K mutant of ANT-4'' with Neomycin and ATP (No Pyrophosphate)

Functional Information from GO Data

Chain	GOid	namespace	contents
A	0000166	molecular_function	nucleotide binding
A	0005524	molecular_function	ATP binding
A	0016740	molecular_function	transferase activity
A	0016779	molecular_function	nucleotidyltransferase activity
A	0046677	biological_process	response to antibiotic
B	0000166	molecular_function	nucleotide binding
B	0005524	molecular_function	ATP binding
B	0016740	molecular_function	transferase activity
B	0016779	molecular_function	nucleotidyltransferase activity
B	0046677	biological_process	response to antibiotic

Functional Information from PDB Data

site_id	AC1
Number of Residues	7
Details	binding site for residue MG A 303

Chain	Residue
A	GLU145
A	MG305
B	ASP50
B	NMY900
B	AMP901
B	HOH1003
B	HOH1016

---

site_id	AC2
Number of Residues	7
Details	binding site for residue MG A 304

Chain	Residue
A	NMY301
A	AMP302
A	HOH445
A	HOH451
B	GLU145
A	ASP50
A	GLU52

---

site_id	AC3
Number of Residues	7
Details	binding site for residue MG A 305

Chain	Residue
A	GLU145
A	MG303
B	GLU76
B	NMY900
B	AMP901
B	HOH1003
B	HOH1005

---

site_id	AC4
Number of Residues	32
Details	binding site for Di-nucleotide NMY A 301 and A A 302

Chain	Residue
A	GLU52
A	GLU63
A	GLU67
A	GLU76
A	ASP80
A	TYR88
A	LEU98
A	THR99
A	GLN102
A	THR187
A	SER188
A	MG304
A	HOH409
A	HOH410
A	HOH418
A	HOH429
A	HOH434
A	HOH451
A	HOH466
A	HOH472
A	HOH481
A	HOH498
A	HOH509
A	HOH525
A	HOH590
B	GLU141
B	GLU145
B	LYS149
B	HOH1031
B	HOH1040
B	HOH1075
B	HOH1090

---

site_id	AC5
Number of Residues	27
Details	binding site for Di-nucleotide NMY B 900 and A B 901

Chain	Residue
A	GLU141
A	GLU145
A	LYS149
A	MG303
A	MG305
A	HOH427
B	TYR37
B	GLU52
B	GLU63
B	GLU67
B	GLU76
B	ASP80
B	TYR88
B	LEU98
B	THR99
B	THR186
B	THR187
B	SER188
B	HOH1005
B	HOH1013
B	HOH1016
B	HOH1019
B	HOH1028
B	HOH1029
B	HOH1037
B	HOH1116
B	HOH1199

---

Functional Information from SwissProt/UniProt

site_id	SWS_FT_FI1
Number of Residues	252
Details	Region: {"description":"N-terminal domain","evidences":[{"source":"PubMed","id":"7577914","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"8218273","evidenceCode":"ECO:0000269"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI2
Number of Residues	226
Details	Region: {"description":"C-terminal domain","evidences":[{"source":"PubMed","id":"7577914","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"8218273","evidenceCode":"ECO:0000269"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI3
Number of Residues	2
Details	Active site: {"description":"Proton acceptor","evidences":[{"source":"PubMed","id":"7577914","evidenceCode":"ECO:0000305"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI4
Number of Residues	8
Details	Binding site: {"evidences":[{"source":"PubMed","id":"7577914","evidenceCode":"ECO:0000305"},{"source":"PDB","id":"1KNY","evidenceCode":"ECO:0000312"},{"source":"PDB","id":"6P06","evidenceCode":"ECO:0007744"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI5
Number of Residues	2
Details	Binding site: {"evidences":[{"source":"PubMed","id":"38250052","evidenceCode":"ECO:0000269"},{"source":"PDB","id":"6NML","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"6NMM","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"6NMN","evidenceCode":"ECO:0007744"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI6
Number of Residues	2
Details	Binding site: {"evidences":[{"source":"PubMed","id":"21040710","evidenceCode":"ECO:0000269"},{"source":"PDB","id":"6UN8","evidenceCode":"ECO:0007744"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI7
Number of Residues	2
Details	Binding site: {"evidences":[{"source":"PDB","id":"6UN8","evidenceCode":"ECO:0007744"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI8
Number of Residues	6
Details	Binding site: {"evidences":[{"source":"PubMed","id":"7577914","evidenceCode":"ECO:0000269"},{"source":"PDB","id":"1KNY","evidenceCode":"ECO:0000312"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI9
Number of Residues	2
Details	Binding site: {"evidences":[{"source":"PubMed","id":"38250052","evidenceCode":"ECO:0000269"},{"source":"PDB","id":"6NMK","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"6NML","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"6NMN","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"6P01","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"6P04","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"6UN8","evidenceCode":"ECO:0007744"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI10
Number of Residues	2
Details	Binding site: {"evidences":[{"source":"PubMed","id":"7577914","evidenceCode":"ECO:0000305"},{"source":"PDB","id":"1KNY","evidenceCode":"ECO:0000312"}]}

Chain

Residue

Details

---

Catalytic Information from CSA

site_id	MCSA1
Number of Residues	4
Details	M-CSA 647

Chain	Residue	Details
A	ASP50	metal ligand
A	GLU52	metal ligand
A	GLU145	activator, proton acceptor, proton donor
A	LYS149	electrostatic stabiliser, polar interaction

---

site_id	MCSA2
Number of Residues	4
Details	M-CSA 647

Chain	Residue	Details
B	ASP50	metal ligand
B	GLU52	metal ligand
B	GLU145	activator, proton acceptor, proton donor
B	LYS149	electrostatic stabiliser, polar interaction

---