6ISO

Human SIRT3 Recognizing H3K4cr

Replaces:  4V1C

Functional Information from GO Data

Chain	GOid	namespace	contents
A	0017136	molecular_function	NAD-dependent histone deacetylase activity
A	0051287	molecular_function	NAD binding
A	0070403	molecular_function	NAD+ binding
B	0017136	molecular_function	NAD-dependent histone deacetylase activity
B	0051287	molecular_function	NAD binding
B	0070403	molecular_function	NAD+ binding
E	0017136	molecular_function	NAD-dependent histone deacetylase activity
E	0051287	molecular_function	NAD binding
E	0070403	molecular_function	NAD+ binding
G	0017136	molecular_function	NAD-dependent histone deacetylase activity
G	0051287	molecular_function	NAD binding
G	0070403	molecular_function	NAD+ binding
I	0017136	molecular_function	NAD-dependent histone deacetylase activity
I	0051287	molecular_function	NAD binding
I	0070403	molecular_function	NAD+ binding
K	0017136	molecular_function	NAD-dependent histone deacetylase activity
K	0051287	molecular_function	NAD binding
K	0070403	molecular_function	NAD+ binding

Functional Information from PDB Data

site_id	AC1
Number of Residues	5
Details	binding site for residue ZN A 401

Chain	Residue
A	CYS256
A	CYS259
A	CYS280
A	CYS283
A	HOH531

---

site_id	AC2
Number of Residues	5
Details	binding site for residue CRD C 101

Chain	Residue
C	LYS2
A	PHE180
A	ILE230
A	HIS248
A	VAL292

---

site_id	AC3
Number of Residues	8
Details	binding site for residue GOL B 401

Chain	Residue
B	ALA146
B	PHE157
B	GLN228
B	HIS248
B	THR320
B	SER321
B	HOH503
D	CRD101

---

site_id	AC4
Number of Residues	4
Details	binding site for residue ZN B 402

Chain	Residue
B	CYS256
B	CYS259
B	CYS280
B	CYS283

---

site_id	AC5
Number of Residues	3
Details	binding site for residue GOL E 401

Chain	Residue
E	GLU323
E	HOH503
F	CRD101

---

site_id	AC6
Number of Residues	4
Details	binding site for residue ZN E 402

Chain	Residue
E	CYS256
E	CYS259
E	CYS280
E	CYS283

---

site_id	AC7
Number of Residues	6
Details	binding site for residue GOL G 401

Chain	Residue
G	GLY145
G	ALA146
G	GLN228
G	HIS248
G	THR320
G	SER321

---

site_id	AC8
Number of Residues	7
Details	binding site for residue ZN G 402

Chain	Residue
G	CYS256
G	VAL258
G	ARG261
G	HOH508
G	HOH530
G	HOH532
G	HOH533

---

site_id	AC9
Number of Residues	4
Details	binding site for residue ZN I 401

Chain	Residue
I	CYS256
I	CYS259
I	CYS280
I	CYS283

---

site_id	AD1
Number of Residues	3
Details	binding site for residue GOL K 401

Chain	Residue
K	GLN228
K	THR320
L	CRD101

---

site_id	AD2
Number of Residues	13
Details	binding site for Di-peptide CRD D 101 and LYS D 2

Chain	Residue
B	PHE157
B	GLN228
B	ILE230
B	HIS248
B	VAL292
B	PHE293
B	PHE294
B	GLY295
B	GLU296
B	GLU325
B	GOL401
D	THR1
D	GLN3

---

site_id	AD3
Number of Residues	10
Details	binding site for Di-peptide CRD F 101 and LYS F 2

Chain	Residue
E	PHE180
E	HIS248
E	VAL292
E	PHE293
E	PHE294
E	GLY295
E	GLU325
E	GOL401
F	THR1
F	GLN3

---

site_id	AD4
Number of Residues	11
Details	binding site for Di-peptide CRD H 101 and LYS H 2

Chain	Residue
G	PHE180
G	ILE230
G	HIS248
G	VAL292
G	PHE293
G	PHE294
G	GLY295
G	GLU296
G	GLU325
H	THR1
H	GLN3

---

site_id	AD5
Number of Residues	10
Details	binding site for Di-peptide CRD J 101 and LYS J 2

Chain	Residue
I	PHE180
I	ILE230
I	HIS248
I	VAL292
I	PHE294
I	GLY295
I	GLU296
I	GLU325
J	THR1
J	GLN3

---

site_id	AD6
Number of Residues	10
Details	binding site for Di-peptide CRD L 101 and LYS L 2

Chain	Residue
K	GLU325
K	GOL401
L	THR1
L	GLN3
K	HIS248
K	VAL292
K	PHE294
K	GLY295
K	GLU296
K	VAL324

---

Functional Information from SwissProt/UniProt

site_id	SWS_FT_FI1
Number of Residues	6
Details	ACT_SITE: Proton acceptor => ECO:0000255|PROSITE-ProRule:PRU00236, ECO:0000269|PubMed:12186850, ECO:0000269|PubMed:16788062, ECO:0000269|PubMed:18794531

Chain	Residue	Details
A	HIS248
B	HIS248
E	HIS248
G	HIS248
I	HIS248
K	HIS248

---

site_id	SWS_FT_FI2
Number of Residues	24
Details	BINDING: BINDING => ECO:0000269|PubMed:23897466

Chain	Residue	Details
A	GLY145
E	GLN228
E	GLY319
E	ASN344
G	GLY145
G	GLN228
G	GLY319
G	ASN344
I	GLY145
I	GLN228
I	GLY319
A	GLN228
I	ASN344
K	GLY145
K	GLN228
K	GLY319
K	ASN344
A	GLY319
A	ASN344
B	GLY145
B	GLN228
B	GLY319
B	ASN344
E	GLY145

---

site_id	SWS_FT_FI3
Number of Residues	24
Details	BINDING: BINDING => ECO:0000269|PubMed:19535340, ECO:0000269|PubMed:23897466

Chain	Residue	Details
A	CYS256
E	CYS259
E	CYS280
E	CYS283
G	CYS256
G	CYS259
G	CYS280
G	CYS283
I	CYS256
I	CYS259
I	CYS280
A	CYS259
I	CYS283
K	CYS256
K	CYS259
K	CYS280
K	CYS283
A	CYS280
A	CYS283
B	CYS256
B	CYS259
B	CYS280
B	CYS283
E	CYS256

---

site_id	SWS_FT_FI4
Number of Residues	6
Details	MOD_RES: N6-succinyllysine => ECO:0000250|UniProtKB:Q8R104

Chain	Residue	Details
A	LYS122
B	LYS122
E	LYS122
G	LYS122
I	LYS122
K	LYS122

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