3KFT

Crystal structure of Pentaerythritol Tetranitrate Reductase complex with 1,4,5,6-tetrahydro NADH

Functional Information from GO Data

Chain	GOid	namespace	contents
A	0005829	cellular_component	cytosol
A	0010181	molecular_function	FMN binding
A	0016491	molecular_function	oxidoreductase activity
A	0016628	molecular_function	oxidoreductase activity, acting on the CH-CH group of donors, NAD or NADP as acceptor
B	0005829	cellular_component	cytosol
B	0010181	molecular_function	FMN binding
B	0016491	molecular_function	oxidoreductase activity
B	0016628	molecular_function	oxidoreductase activity, acting on the CH-CH group of donors, NAD or NADP as acceptor

Functional Information from PDB Data

site_id	AC1
Number of Residues	19
Details	BINDING SITE FOR RESIDUE FMN A 365

Chain	Residue
A	ALA23
A	GLY301
A	ALA302
A	GLY323
A	ARG324
A	TYR351
A	NAD366
A	HOH368
A	HOH444
A	HOH506
A	HOH507
A	PRO24
A	LEU25
A	THR26
A	ALA58
A	GLN100
A	HIS181
A	HIS184
A	ARG233

---

site_id	AC2
Number of Residues	18
Details	BINDING SITE FOR RESIDUE NAD A 366

Chain	Residue
A	THR26
A	TRP102
A	ARG142
A	HIS181
A	HIS184
A	TYR186
A	ARG324
A	TYR351
A	FMN365
A	HOH425
A	HOH502
A	HOH550
A	HOH593
A	HOH626
B	ARG324
B	PRO347
B	GLU348
B	NAD366

---

site_id	AC3
Number of Residues	18
Details	BINDING SITE FOR RESIDUE FMN B 365

Chain	Residue
B	ALA23
B	PRO24
B	LEU25
B	THR26
B	ALA58
B	GLN100
B	HIS181
B	HIS184
B	ARG233
B	GLY301
B	ALA302
B	GLY323
B	ARG324
B	TYR351
B	NAD366
B	HOH534
B	HOH551
B	HOH599

---

site_id	AC4
Number of Residues	18
Details	BINDING SITE FOR RESIDUE NAD B 366

Chain	Residue
A	ARG324
A	PRO347
A	GLU348
A	NAD366
A	HOH422
B	THR26
B	TRP102
B	HIS181
B	HIS184
B	TYR186
B	GLN241
B	ASP274
B	TYR351
B	FMN365
B	HOH447
B	HOH493
B	HOH563
B	HOH581

---

Functional Information from SwissProt/UniProt

site_id	SWS_FT_FI1
Number of Residues	2
Details	Active site: {"description":"Proton donor","evidences":[{"source":"PubMed","id":"11428899","evidenceCode":"ECO:0000305"},{"source":"PubMed","id":"11923299","evidenceCode":"ECO:0000305"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI2
Number of Residues	2
Details	Binding site: {"evidences":[{"source":"PubMed","id":"11428899","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"11923299","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"15128738","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"19891489","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"21064170","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"21374779","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"28177310","evidenceCode":"ECO:0000269"},{"source":"PDB","id":"1GVO","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1GVQ","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1GVR","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1GVS","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1H50","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1H51","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1H60","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1H61","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1H62","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1H63","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1VYP","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1VYR","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1VYS","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"3KFT","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"3P62","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"3P67","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"3P74","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"3P7Y","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"3P80","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"3P81","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"3P82","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"3P84","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"3P8I","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"3P8J","evidenceCode":"ECO:0007744"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI3
Number of Residues	2
Details	Binding site: {"evidences":[{"source":"PubMed","id":"11428899","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"11923299","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"15128738","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"16156787","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"19891489","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"21064170","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"21374779","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"28177310","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"31119061","evidenceCode":"ECO:0000269"},{"source":"PDB","id":"1GVO","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1GVQ","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1GVR","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1GVS","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1H50","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1H51","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1H60","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1H61","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1H62","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1H63","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1VYP","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1VYR","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1VYS","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"2ABA","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"2ABB","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"3KFT","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"3P62","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"3P74","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"3P7Y","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"3P80","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"3P81","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"3P82","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"3P84","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"3P8I","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"3P8J","evidenceCode":"ECO:0007744"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI4
Number of Residues	12
Details	Binding site: {"evidences":[{"source":"PubMed","id":"11428899","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"11923299","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"15128738","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"16156787","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"19891489","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"21064170","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"21374779","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"28177310","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"31119061","evidenceCode":"ECO:0000269"},{"source":"PDB","id":"1GVO","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1GVQ","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1GVR","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1GVS","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1H50","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1H51","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1H60","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1H61","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1H62","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1H63","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1VYP","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1VYR","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1VYS","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"2ABA","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"2ABB","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"3KFT","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"3P62","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"3P67","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"3P74","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"3P7Y","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"3P80","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"3P81","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"3P82","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"3P84","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"3P8I","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"3P8J","evidenceCode":"ECO:0007744"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI5
Number of Residues	2
Details	Binding site: {"evidences":[{"source":"PubMed","id":"16156787","evidenceCode":"ECO:0000269"},{"source":"PDB","id":"2ABA","evidenceCode":"ECO:0007744"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI6
Number of Residues	4
Details	Binding site: {"evidences":[{"source":"PubMed","id":"11428899","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"16156787","evidenceCode":"ECO:0000269"},{"source":"PDB","id":"1H60","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"2ABA","evidenceCode":"ECO:0007744"}]}

Chain

Residue

Details

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