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1OH0

CRYSTAL STRUCTURE OF KETOSTEROID ISOMERASE COMPLEXED WITH EQUILENIN

Replaces:  4TSU
Functional Information from GO Data
ChainGOidnamespacecontents
A0004769molecular_functionsteroid Delta-isomerase activity
A0006629biological_processlipid metabolic process
A0008202biological_processsteroid metabolic process
A0016853molecular_functionisomerase activity
B0004769molecular_functionsteroid Delta-isomerase activity
B0006629biological_processlipid metabolic process
B0008202biological_processsteroid metabolic process
B0016853molecular_functionisomerase activity
Functional Information from PDB Data
site_idAC1
Number of Residues9
DetailsBINDING SITE FOR RESIDUE EQU A1128
ChainResidue
ATYR16
AASP40
APHE86
AMET90
AASP103
AMET116
ATRP120
BTRP292
BASN293

site_idAC2
Number of Residues10
DetailsBINDING SITE FOR RESIDUE EQU B1331
ChainResidue
AASN93
BTYR216
BASP240
BPHE286
BMET290
BLEU299
BASP303
BMET316
BTRP320
BHOH2068

site_idAC3
Number of Residues3
DetailsBINDING SITE FOR RESIDUE BME B1332
ChainResidue
BCYS269
BARG287
BGLU289

Functional Information from SwissProt/UniProt
site_idSWS_FT_FI1
Number of Residues2
DetailsActive site: {"description":"Proton donor"}
ChainResidueDetails

site_idSWS_FT_FI2
Number of Residues2
DetailsActive site: {"description":"Proton acceptor"}
ChainResidueDetails

site_idSWS_FT_FI3
Number of Residues2
DetailsBinding site: {"evidences":[{"source":"PubMed","id":"11007792","evidenceCode":"ECO:0000269"}]}
ChainResidueDetails

Catalytic Information from CSA
site_idCSA1
Number of Residues5
DetailsAnnotated By Reference To The Literature 1e3v
ChainResidueDetails
AASP103
AASP40
ATYR32
ATYR16
ATYR57

site_idCSA2
Number of Residues5
DetailsAnnotated By Reference To The Literature 1e3v
ChainResidueDetails
BTYR216
BTYR257
BASP240
BASP303
BTYR232

site_idCSA3
Number of Residues3
DetailsAnnotated By Reference To The Literature 1e3v
ChainResidueDetails
AASP103
AASP40
ATYR16

site_idCSA4
Number of Residues3
DetailsAnnotated By Reference To The Literature 1e3v
ChainResidueDetails
BTYR216
BASP303
BASP240

site_idMCSA1
Number of Residues4
DetailsM-CSA 349
ChainResidueDetails
ATYR16proton acceptor, proton donor
AASP40proton acceptor, proton donor
AASP100electrostatic stabiliser
AASP103electrostatic stabiliser

site_idMCSA2
Number of Residues4
DetailsM-CSA 349
ChainResidueDetails
BTYR216proton acceptor, proton donor
BASP240proton acceptor, proton donor
BASP300electrostatic stabiliser
BASP303electrostatic stabiliser

246031

PDB entries from 2025-12-10

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