Summary Structural details Experimental details Functional details Sequence Neighbor History Downloads

4C7J

11b-Hydroxysteroid Dehydrogenase Type I in complex with inhibitor

Functional Information from GO Data

Chain	GOid	namespace	contents
A	0005496	molecular_function	steroid binding
A	0005783	cellular_component	endoplasmic reticulum
A	0005789	cellular_component	endoplasmic reticulum membrane
A	0006629	biological_process	lipid metabolic process
A	0006706	biological_process	steroid catabolic process
A	0006713	biological_process	glucocorticoid catabolic process
A	0008202	biological_process	steroid metabolic process
A	0016020	cellular_component	membrane
A	0016491	molecular_function	oxidoreductase activity
A	0042803	molecular_function	protein homodimerization activity
A	0047022	molecular_function	7-beta-hydroxysteroid dehydrogenase (NADP+) activity
A	0050661	molecular_function	NADP binding
A	0070524	molecular_function	11-beta-hydroxysteroid dehydrogenase (NADP+) activity
A	0102196	molecular_function	cortisol dehydrogenase (NADP+) activity
B	0005496	molecular_function	steroid binding
B	0005783	cellular_component	endoplasmic reticulum
B	0005789	cellular_component	endoplasmic reticulum membrane
B	0006629	biological_process	lipid metabolic process
B	0006706	biological_process	steroid catabolic process
B	0006713	biological_process	glucocorticoid catabolic process
B	0008202	biological_process	steroid metabolic process
B	0016020	cellular_component	membrane
B	0016491	molecular_function	oxidoreductase activity
B	0042803	molecular_function	protein homodimerization activity
B	0047022	molecular_function	7-beta-hydroxysteroid dehydrogenase (NADP+) activity
B	0050661	molecular_function	NADP binding
B	0070524	molecular_function	11-beta-hydroxysteroid dehydrogenase (NADP+) activity
B	0102196	molecular_function	cortisol dehydrogenase (NADP+) activity
C	0005496	molecular_function	steroid binding
C	0005783	cellular_component	endoplasmic reticulum
C	0005789	cellular_component	endoplasmic reticulum membrane
C	0006629	biological_process	lipid metabolic process
C	0006706	biological_process	steroid catabolic process
C	0006713	biological_process	glucocorticoid catabolic process
C	0008202	biological_process	steroid metabolic process
C	0016020	cellular_component	membrane
C	0016491	molecular_function	oxidoreductase activity
C	0042803	molecular_function	protein homodimerization activity
C	0047022	molecular_function	7-beta-hydroxysteroid dehydrogenase (NADP+) activity
C	0050661	molecular_function	NADP binding
C	0070524	molecular_function	11-beta-hydroxysteroid dehydrogenase (NADP+) activity
C	0102196	molecular_function	cortisol dehydrogenase (NADP+) activity
D	0005496	molecular_function	steroid binding
D	0005783	cellular_component	endoplasmic reticulum
D	0005789	cellular_component	endoplasmic reticulum membrane
D	0006629	biological_process	lipid metabolic process
D	0006706	biological_process	steroid catabolic process
D	0006713	biological_process	glucocorticoid catabolic process
D	0008202	biological_process	steroid metabolic process
D	0016020	cellular_component	membrane
D	0016491	molecular_function	oxidoreductase activity
D	0042803	molecular_function	protein homodimerization activity
D	0047022	molecular_function	7-beta-hydroxysteroid dehydrogenase (NADP+) activity
D	0050661	molecular_function	NADP binding
D	0070524	molecular_function	11-beta-hydroxysteroid dehydrogenase (NADP+) activity
D	0102196	molecular_function	cortisol dehydrogenase (NADP+) activity

Functional Information from PDB Data

site_id	AC1
Number of Residues	30
Details	BINDING SITE FOR RESIDUE NAP A 1286

Chain	Residue
A	GLY41
A	MET93
A	ASN119
A	ILE121
A	VAL168
A	SER169
A	TYR183
A	LYS187
A	LEU215
A	GLY216
A	LEU217
A	SER43
A	ILE218
A	THR220
A	THR222
A	ALA223
A	4YQ1287
A	HOH2015
A	HOH2016
A	HOH2018
A	HOH2044
A	HOH2096
A	LYS44
A	HOH2188
A	GLY45
A	ILE46
A	ALA65
A	ARG66
A	SER67
A	THR92

site_id	AC2
Number of Residues	34
Details	BINDING SITE FOR RESIDUE NAP B 1292

Chain	Residue
B	GLY41
B	ALA42
B	SER43
B	LYS44
B	GLY45
B	ILE46
B	ALA65
B	ARG66
B	SER67
B	THR92
B	MET93
B	ASN119
B	ILE121
B	VAL168
B	SER169
B	SER170
B	TYR183
B	LYS187
B	LEU215
B	GLY216
B	LEU217
B	ILE218
B	THR220
B	THR222
B	ALA223
B	4YQ1293
B	HOH2008
B	HOH2009
B	HOH2012
B	HOH2032
B	HOH2132
B	HOH2164
B	HOH2165
B	HOH2166

site_id	AC3
Number of Residues	35
Details	BINDING SITE FOR RESIDUE NAP C 1282

Chain	Residue
C	GLY41
C	ALA42
C	SER43
C	LYS44
C	GLY45
C	ILE46
C	ALA65
C	ARG66
C	SER67
C	THR92
C	MET93
C	ASN119
C	ILE121
C	VAL168
C	SER169
C	SER170
C	TYR183
C	LYS187
C	LEU215
C	GLY216
C	LEU217
C	ILE218
C	THR220
C	THR222
C	ALA223
C	4YQ1283
C	HOH2010
C	HOH2011
C	HOH2012
C	HOH2013
C	HOH2014
C	HOH2025
C	HOH2061
C	HOH2151
C	HOH2152

site_id	AC4
Number of Residues	29
Details	BINDING SITE FOR RESIDUE NAP D 1283

Chain	Residue
D	GLY41
D	ALA42
D	SER43
D	LYS44
D	GLY45
D	ILE46
D	ALA65
D	ARG66
D	SER67
D	THR92
D	MET93
D	ASN119
D	ILE121
D	VAL168
D	SER169
D	SER170
D	TYR183
D	LYS187
D	LEU215
D	GLY216
D	LEU217
D	ILE218
D	THR220
D	THR222
D	ALA223
D	4YQ1284
D	HOH2007
D	HOH2025
D	HOH2074

site_id	AC5
Number of Residues	13
Details	BINDING SITE FOR RESIDUE 4YQ A 1287

Chain	Residue
A	SER170
A	TYR177
A	TYR183
A	LEU215
A	GLY216
A	LEU217
A	MET233
A	ASP259
A	NAP1286
A	HOH2097
A	HOH2160
B	TYR280
B	TYR284

site_id	AC6
Number of Residues	17
Details	BINDING SITE FOR RESIDUE 4YQ B 1293

Chain	Residue
A	TYR280
A	TYR284
B	THR124
B	SER170
B	LEU171
B	TYR177
B	TYR183
B	LEU215
B	GLY216
B	LEU217
B	THR222
B	ALA226
B	MET233
B	ASP259
B	NAP1292
B	HOH2081
B	HOH2164

site_id	AC7
Number of Residues	16
Details	BINDING SITE FOR RESIDUE 4YQ C 1283

Chain	Residue
C	THR124
C	LEU126
C	SER170
C	TYR177
C	TYR183
C	LEU215
C	GLY216
C	LEU217
C	THR222
C	ALA226
C	MET233
C	ASP259
C	NAP1282
C	HOH2063
C	HOH2151
D	TYR280

site_id	AC8
Number of Residues	10
Details	BINDING SITE FOR RESIDUE 4YQ D 1284

Chain	Residue
D	LEU126
D	SER170
D	TYR177
D	TYR183
D	LEU215
D	LEU217
D	ALA226
D	ASP259
D	NAP1283
D	HOH2042

Functional Information from PROSITE/UniProt

site_id	PS00061
Number of Residues	29
Details	ADH_SHORT Short-chain dehydrogenases/reductases family signature. SlagkvayplVaaYSASKFALdGFFsSIR

Chain	Residue	Details
A	SER170-ARG198

Functional Information from SwissProt/UniProt

site_id	SWS_FT_FI1
Number of Residues	4
Details	Active site: {"description":"Proton acceptor"}

Chain

Residue

Details

site_id	SWS_FT_FI2
Number of Residues	148
Details	Binding site: {"evidences":[{"source":"PubMed","id":"15513927","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"17919905","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"18069989","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"18485702","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"18553955","evidenceCode":"ECO:0000269"},{"source":"PubMed","id":"19217779","evidenceCode":"ECO:0000269"}]}

Chain

Residue

Details

site_id	SWS_FT_FI3
Number of Residues	4
Details	Binding site: {"evidences":[{"source":"PubMed","id":"15513927","evidenceCode":"ECO:0000269"},{"source":"PDB","id":"1XU7","evidenceCode":"ECO:0007744"},{"source":"PDB","id":"1XU9","evidenceCode":"ECO:0007744"}]}

Chain

Residue

Details

site_id	SWS_FT_FI4
Number of Residues	8
Details	Glycosylation: {"description":"N-linked (GlcNAc...) asparagine","evidences":[{"source":"PubMed","id":"19159218","evidenceCode":"ECO:0000269"}]}

Chain

Residue

Details

site_id	SWS_FT_FI5
Number of Residues	4
Details	Glycosylation: {"description":"N-linked (GlcNAc...) asparagine","evidences":[{"evidenceCode":"ECO:0000255"}]}

Chain

Residue

Details

		Sequence (fasta)
		PDBx/mmCIF
		PDBML format (no-atom)
		PDB format (full)
		Validation report (PDF)
		EDMap 2fo-fc (MTZ)