4DRH

Co-crystal structure of the PPIase domain of FKBP51, Rapamycin and the FRB fragment of mTOR at low pH

Functional Information from GO Data

Chain	GOid	namespace	contents
A	0003755	molecular_function	peptidyl-prolyl cis-trans isomerase activity
B	0044877	molecular_function	protein-containing complex binding
D	0003755	molecular_function	peptidyl-prolyl cis-trans isomerase activity
E	0044877	molecular_function	protein-containing complex binding

Functional Information from PDB Data

site_id	AC1
Number of Residues	21
Details	BINDING SITE FOR RESIDUE RAP A 201

Chain	Residue
A	TYR57
A	TRP90
A	TYR113
A	LYS121
A	PHE130
B	LEU2031
B	SER2035
B	PHE2039
B	THR2098
B	TRP2101
B	ASP2102
A	PHE67
B	TYR2105
B	PHE2108
A	ASP68
A	HIS71
A	PHE77
A	GLY84
A	GLN85
A	VAL86
A	ILE87

---

site_id	AC2
Number of Residues	9
Details	BINDING SITE FOR RESIDUE SO4 A 202

Chain	Residue
A	ASP68
A	SER69
A	SER70
A	LYS121
A	HOH309
A	HOH319
A	HOH320
B	LYS2095
B	THR2098

---

site_id	AC3
Number of Residues	3
Details	BINDING SITE FOR RESIDUE SO4 A 203

Chain	Residue
A	LYS58
A	LYS60
A	LYS66

---

site_id	AC4
Number of Residues	5
Details	BINDING SITE FOR RESIDUE SO4 A 204

Chain	Residue
A	SER13
A	PRO14
A	THR15
A	LYS60
A	HOH317

---

site_id	AC5
Number of Residues	4
Details	BINDING SITE FOR RESIDUE SO4 A 205

Chain	Residue
A	ARG31
A	ARG31
A	LYS108
A	LYS108

---

site_id	AC6
Number of Residues	4
Details	BINDING SITE FOR RESIDUE SO4 A 206

Chain	Residue
A	LYS52
A	TYR54
B	SER2069
B	ARG2110

---

site_id	AC7
Number of Residues	4
Details	BINDING SITE FOR RESIDUE SO4 A 207

Chain	Residue
A	THR26
A	SER27
A	LYS28
A	TYR111

---

site_id	AC8
Number of Residues	6
Details	BINDING SITE FOR RESIDUE SO4 A 208

Chain	Residue
A	GLU12
A	PRO14
A	LYS38
A	HIS104
A	HOH324
A	HOH326

---

site_id	AC9
Number of Residues	5
Details	BINDING SITE FOR RESIDUE SO4 B 2201

Chain	Residue
A	LYS99
A	ASP136
B	THR2064
B	LEU2065
B	HOH2321

---

site_id	BC1
Number of Residues	2
Details	BINDING SITE FOR RESIDUE SO4 B 2202

Chain	Residue
B	LYS2045
B	ARG2086

---

site_id	BC2
Number of Residues	3
Details	BINDING SITE FOR RESIDUE SO4 B 2203

Chain	Residue
B	TYR2074
B	ARG2110
B	ARG2110

---

site_id	BC3
Number of Residues	7
Details	BINDING SITE FOR RESIDUE SO4 B 2204

Chain	Residue
A	GLU75
B	GLN2072
B	ARG2076
B	HIS2106
B	ARG2109
B	HOH2308
B	HOH2325

---

site_id	BC4
Number of Residues	22
Details	BINDING SITE FOR RESIDUE RAP D 201

Chain	Residue
B	HOH2316
D	TYR57
D	PHE67
D	ASP68
D	HIS71
D	PHE77
D	GLY84
D	GLN85
D	VAL86
D	ILE87
D	TRP90
D	TYR113
D	PHE130
E	LEU2031
E	SER2035
E	ARG2036
E	PHE2039
E	THR2098
E	TRP2101
E	ASP2102
E	TYR2105
E	PHE2108

---

site_id	BC5
Number of Residues	4
Details	BINDING SITE FOR RESIDUE SO4 D 202

Chain	Residue
D	SER13
D	PRO14
D	THR15
D	LYS60

---

site_id	BC6
Number of Residues	4
Details	BINDING SITE FOR RESIDUE SO4 D 203

Chain	Residue
D	GLU12
D	PRO14
D	LYS38
D	HIS104

---

site_id	BC7
Number of Residues	5
Details	BINDING SITE FOR RESIDUE SO4 D 204

Chain	Residue
D	PHE67
D	ASP68
D	SER69
D	SER70
D	HOH317

---

site_id	BC8
Number of Residues	3
Details	BINDING SITE FOR RESIDUE SO4 D 205

Chain	Residue
D	LYS58
D	LYS60
D	LYS66

---

site_id	BC9
Number of Residues	4
Details	BINDING SITE FOR RESIDUE SO4 E 2201

Chain	Residue
E	TYR2105
E	HIS2106
E	ARG2109
E	HOH2302

---

site_id	CC1
Number of Residues	3
Details	BINDING SITE FOR RESIDUE SO4 E 2202

Chain	Residue
E	LYS2045
E	ARG2086
E	HOH2307

---

site_id	CC2
Number of Residues	3
Details	BINDING SITE FOR RESIDUE SO4 E 2203

Chain	Residue
D	LYS52
D	TYR54
E	ARG2109

---

site_id	CC3
Number of Residues	6
Details	BINDING SITE FOR RESIDUE SO4 E 2204

Chain	Residue
B	HIS2028
B	GLU2029
B	GLU2032
E	HIS2028
E	GLU2029
E	GLU2032

---

site_id	CC4
Number of Residues	2
Details	BINDING SITE FOR RESIDUE SO4 E 2205

Chain	Residue
E	GLN2082
E	HOH2305

---

site_id	CC5
Number of Residues	3
Details	BINDING SITE FOR RESIDUE SO4 E 2206

Chain	Residue
D	ARG39
E	ASP2077
E	HIS2106

---

Functional Information from SwissProt/UniProt

site_id	SWS_FT_FI1
Number of Residues	176
Details	Domain: {"description":"PPIase FKBP-type 1","evidences":[{"source":"PROSITE-ProRule","id":"PRU00277","evidenceCode":"ECO:0000255"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI2
Number of Residues	2
Details	Modified residue: {"description":"Phosphoserine","evidences":[{"source":"PubMed","id":"23186163","evidenceCode":"ECO:0007744"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI3
Number of Residues	2
Details	Modified residue: {"description":"N6-acetyllysine","evidences":[{"source":"PubMed","id":"28147277","evidenceCode":"ECO:0000269"}]}

Chain

Residue

Details

---

site_id	SWS_FT_FI4
Number of Residues	4
Details	Cross-link: {"description":"Glycyl lysine isopeptide (Lys-Gly) (interchain with G-Cter in ubiquitin)","evidences":[{"source":"PubMed","id":"37979583","evidenceCode":"ECO:0000269"}]}

Chain

Residue

Details

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