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5IEN

Structure of CDL2.2, a computationally designed Vitamin-D3 binder

Entity
Entity IDChain IDDescriptionTypeChain lengthFormula weightNumber of moleculesDB Name (Accession)Biological sourceDescriptive keywords
1A, B
(A, B)
CDL2.2polymer13715061.92synthetic construct
2C, E
(A, B)
3-{2-[1-(5-HYDROXY-1,5-DIMETHYL-HEXYL)-7A-METHYL-OCTAHYDRO-INDEN-4-YLIDENE]-ETHYLIDENE}-4-METHYLENE-CYCLOHEXANOLnon-polymer400.62Chemie (VDY)
PubChem (29553)
PubChem (166583)
PubChem (439521)
PubChem (457171)
PubChem (5283731)
PubChem (5283732)
PubChem (6368826)
PubChem (6441384)
PubChem (6474052)
PubChem (9952843)
PubChem (10363641)
PubChem (11258101)
PubChem (11668477)
PubChem (12925910)
PubChem (12925912)
PubChem (16759356)
PubChem (25057170)
PubChem (34173403)
PubChem (34173408)
PubChem (34173414)
PubChem (42051900)
PubChem (44263352)
PubChem (176519910)
PubChem (46705323)
PubChem (46780150)
PubChem (24779641)
PubChem (50990070)
PubChem (1593)
PubChem (73946424)
PubChem (88810851)
PubChem (5280447)
PubChem (53477885)
PubChem (5353325)
PubChem (6096879)
PubChem (53978735)
PubChem (53978738)
PubChem (6433735)
PubChem (6506392)
PubChem (126968450)
PubChem (57060915)
PubChem (57484437)
PubChem (57853708)
PubChem (12925914)
PubChem (58242938)
PubChem (154009141)
PubChem (155982231)
PubChem (59361100)
PubChem (73950899)
PubChem (87866151)
PubChem (87939581)
PubChem (88536855)
PubChem (88909328)
PubChem (89194262)
PubChem (89220612)
PubChem (89640983)
PubChem (89735755)
PubChem (90364677)
PubChem (90685541)
PubChem (91161936)
PubChem (91501281)
PubChem (91564226)
PubChem (91864756)
PubChem (93028257)
PubChem (93028258)
PubChem (93028259)
PubChem (101349295)
PubChem (118855588)
PubChem (123358575)
PubChem (127243452)
PubChem (129010234)
PubChem (129606952)
PubChem (132019619)
PubChem (132139048)
PubChem (132342668)
PubChem (132342687)
PubChem (134693192)
PubChem (134694705)
PubChem (135391164)
PubChem (137704803)
PubChem (138114328)
PubChem (139595671)
PubChem (142060506)
PubChem (144054497)
PubChem (154701710)
PubChem (154701712)
PubChem (155096562)
PubChem (162357991)
PubChem (162988290)
PubChem (162988291)
PubChem (164806043)
PubChem (173515912)
PubChem (173519273)
PubChem (173632132)
PubChem (173984595)
PubChem (175322219)
3D
(A)
GLYCEROLnon-polymer92.11Chemie (GOL)
PubChem (753)
4F, G
(A, B)
waterwater18.083Chemie (HOH)
Sequence viewer
Contents of the asymmetric unit
PolymersNumber of chains2
Total formula weight30123.9
Non-Polymers*Number of molecules3
Total formula weight893.4
All*Total formula weight31017.3
*Water molecules are not included.

251801

PDB entries from 2026-04-08

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