7ER8

Crystal structure of human Biliverdin IX-beta reductase B with Sulfasalazine (SAS)

Functional Information from GO Data

Chain	GOid	namespace	contents
A	0004074	molecular_function	biliverdin reductase [NAD(P)H] activity
A	0005515	molecular_function	protein binding
A	0005737	cellular_component	cytoplasm
A	0005829	cellular_component	cytosol
A	0016491	molecular_function	oxidoreductase activity
A	0016740	molecular_function	transferase activity
A	0030219	biological_process	megakaryocyte differentiation
A	0035605	molecular_function	peptidyl-cysteine S-nitrosylase activity
A	0042167	biological_process	heme catabolic process
A	0042602	molecular_function	riboflavin reductase (NADPH) activity
A	0046627	biological_process	negative regulation of insulin receptor signaling pathway
A	0052873	molecular_function	FMN reductase (NADPH) activity
A	0052874	molecular_function	FMN reductase (NADH) activity
A	0070062	cellular_component	extracellular exosome
B	0004074	molecular_function	biliverdin reductase [NAD(P)H] activity
B	0005515	molecular_function	protein binding
B	0005737	cellular_component	cytoplasm
B	0005829	cellular_component	cytosol
B	0016491	molecular_function	oxidoreductase activity
B	0016740	molecular_function	transferase activity
B	0030219	biological_process	megakaryocyte differentiation
B	0035605	molecular_function	peptidyl-cysteine S-nitrosylase activity
B	0042167	biological_process	heme catabolic process
B	0042602	molecular_function	riboflavin reductase (NADPH) activity
B	0046627	biological_process	negative regulation of insulin receptor signaling pathway
B	0052873	molecular_function	FMN reductase (NADPH) activity
B	0052874	molecular_function	FMN reductase (NADH) activity
B	0070062	cellular_component	extracellular exosome

Functional Information from PDB Data

site_id	AC1
Number of Residues	39
Details	binding site for residue NAP A 401

Chain	Residue
A	GLY10
A	LEU74
A	LEU75
A	GLY76
A	THR77
A	ARG78
A	VAL86
A	MET87
A	CYS109
A	THR110
A	SER111
A	THR12
A	HIS132
A	PRO151
A	PRO152
A	HIS153
A	ILE154
A	SAS402
A	HOH517
A	HOH536
A	HOH541
A	HOH548
A	GLY13
A	HOH570
A	HOH588
A	HOH589
A	HOH596
A	HOH603
A	HOH635
A	HOH655
A	HOH661
B	SER82
B	HOH532
A	GLN14
A	THR15
A	ARG35
A	SER38
A	ASP54
A	VAL55

---

site_id	AC2
Number of Residues	11
Details	binding site for residue SAS A 402

Chain	Residue
A	HIS0
A	PHE113
A	TRP116
A	PRO152
A	HIS153
A	ARG170
A	GLY171
A	ARG174
A	TYR200
A	NAP401
A	HOH565

---

site_id	AC3
Number of Residues	3
Details	binding site for residue SO4 A 403

Chain	Residue
A	HIS136
A	ARG140
A	HOH506

---

site_id	AC4
Number of Residues	3
Details	binding site for residue SO4 A 404

Chain	Residue
A	HIS183
A	HOH650
B	LYS4

---

site_id	AC5
Number of Residues	34
Details	binding site for residue NAP B 401

Chain	Residue
A	SER37
B	GLY10
B	THR12
B	GLY13
B	GLN14
B	THR15
B	ARG35
B	ARG39
B	ASP54
B	VAL55
B	LEU74
B	LEU75
B	GLY76
B	ARG78
B	MET87
B	CYS109
B	THR110
B	SER111
B	HIS132
B	PRO151
B	PRO152
B	ILE154
B	SAS402
B	HOH513
B	HOH514
B	HOH530
B	HOH531
B	HOH548
B	HOH576
B	HOH588
B	HOH591
B	HOH597
B	HOH600
B	HOH605

---

site_id	AC6
Number of Residues	17
Details	binding site for residue SAS B 402

Chain	Residue
B	ARG124
B	PRO152
B	HIS153
B	NAP401
B	HOH503
B	HOH508
B	HOH515
B	HOH552
A	GLU89
A	ARG134
B	THR77
B	ASN79
B	ASP80
B	LEU81
B	SER111
B	PHE113
B	TRP116

---

site_id	AC7
Number of Residues	9
Details	binding site for residue SO4 B 403

Chain	Residue
A	LYS137
A	ARG140
B	HIS153
B	GLY155
B	ASP156
B	GLN157
B	VAL175
B	HOH516
B	HOH551

---

site_id	AC8
Number of Residues	4
Details	binding site for residue SO4 B 404

Chain	Residue
B	VAL3
B	ALA26
B	TYR28
B	HOH519

---

site_id	AC9
Number of Residues	5
Details	binding site for residue SO4 B 405

Chain	Residue
B	LYS178
B	HIS179
B	HOH534
B	HOH555
B	HOH621

---

Functional Information from SwissProt/UniProt

site_id	SWS_FT_FI1
Number of Residues	4
Details	Active site: {"description":"S-nitroso-cysteine intermediate; for S-nitroso-CoA-dependent nitrosyltransferase activity","evidences":[{"source":"PubMed","id":"38056462","evidenceCode":"ECO:0000269"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI2
Number of Residues	2
Details	Binding site: {"evidences":[{"source":"PubMed","id":"11224564","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"29487133","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"34957824","evidenceCode":"ECO:0000269"},{"source":"PDB","id":"1HDO","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"5OOG","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"5OOH","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ER7","evidenceCode":"ECO:0007744"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI3
Number of Residues	16
Details	Binding site: {"evidences":[{"source":"PubMed","id":"11224564","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"29487133","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"32246827","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"34957824","evidenceCode":"ECO:0000269"},{"source":"PDB","id":"1HDO","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1HE2","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1HE3","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1HE4","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1HE5","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"5OOG","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"5OOH","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"6OPL","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ER6","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ER7","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ER8","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ER9","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ERA","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ERB","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ERC","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ERD","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ERE","evidenceCode":"ECO:0007744"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI4
Number of Residues	2
Details	Binding site: {"evidences":[{"source":"PubMed","id":"11224564","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"32246827","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"34957824","evidenceCode":"ECO:0000269"},{"source":"PDB","id":"1HDO","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1HE2","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1HE3","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1HE4","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1HE5","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"5OOG","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"5OOH","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"6OPL","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ER6","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ER7","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ER8","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ER9","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ERA","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ERB","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ERC","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ERD","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ERE","evidenceCode":"ECO:0007744"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI5
Number of Residues	4
Details	Binding site: {"evidences":[{"source":"PubMed","id":"11224564","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"29487133","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"34957824","evidenceCode":"ECO:0000269"},{"source":"PDB","id":"1HDO","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1HE2","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1HE3","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1HE4","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1HE5","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"5OOG","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"5OOH","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ER6","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ER7","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ER8","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ER9","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ERA","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ERB","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ERC","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ERD","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ERE","evidenceCode":"ECO:0007744"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI6
Number of Residues	2
Details	Binding site: {"evidences":[{"source":"PubMed","id":"34957824","evidenceCode":"ECO:0000269"},{"source":"PDB","id":"7ER6","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ER9","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ERA","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ERB","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ERD","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ERE","evidenceCode":"ECO:0007744"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI7
Number of Residues	2
Details	Binding site: {"evidences":[{"source":"PubMed","id":"29487133","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"32246827","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"34957824","evidenceCode":"ECO:0000269"},{"source":"PDB","id":"5OOH","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"6OPL","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ER6","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ER7","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ER8","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ER9","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ERA","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ERB","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ERC","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ERE","evidenceCode":"ECO:0007744"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI8
Number of Residues	2
Details	Binding site: {"evidences":[{"source":"PubMed","id":"11224564","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"32246827","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"34957824","evidenceCode":"ECO:0000269"},{"source":"PDB","id":"1HDO","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1HE2","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1HE3","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1HE4","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1HE5","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"6OPL","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ER6","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ER7","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ER8","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ER9","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ERA","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ERB","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ERC","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ERD","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ERE","evidenceCode":"ECO:0007744"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI9
Number of Residues	2
Details	Binding site: {"evidences":[{"source":"PubMed","id":"11224564","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"29487133","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"32246827","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"34957824","evidenceCode":"ECO:0000269"},{"source":"PDB","id":"1HDO","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1HE2","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1HE3","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1HE4","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1HE5","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"5OOH","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"6OPL","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ER6","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ER7","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ER8","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ER9","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ERA","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ERB","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ERC","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ERD","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ERE","evidenceCode":"ECO:0007744"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI10
Number of Residues	2
Details	Binding site: {"evidences":[{"source":"PubMed","id":"11224564","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"29487133","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"32246827","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"34957824","evidenceCode":"ECO:0000269"},{"source":"PDB","id":"1HE3","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"5OOG","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"5OOH","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"6OPL","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ER8","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ER9","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ERB","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ERC","evidenceCode":"ECO:0007744"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI11
Number of Residues	2
Details	Binding site: {"evidences":[{"source":"PubMed","id":"32246827","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"34957824","evidenceCode":"ECO:0000269"},{"source":"PDB","id":"6OPL","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ERB","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"7ERD","evidenceCode":"ECO:0007744"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI12
Number of Residues	2
Details	Modified residue: {"description":"Phosphoserine","evidences":[{"source":"PubMed","id":"24275569","evidenceCode":"ECO:0007744"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI13
Number of Residues	2
Details	Modified residue: {"description":"Phosphoserine","evidences":[{"source":"PubMed","id":"23186163","evidenceCode":"ECO:0007744"}]}

Chain

Residue

Details

---