Information card for entry 7247985

Structure parameters

• Formula: C35.5 H40 Cl N O6
• Calculated formula: C35.5 H40 Cl N O6
• Title of publication: Minimising the payload solvent exposed hydrophobic surface area optimises the antibody-drug conjugate properties
• Authors of publication: Hobson, Adrian D.; Zhu, Haizhong; Qiu, Wei; Judge, Russell; Longenecker, Kenton
• Journal of publication: RSC Medicinal Chemistry
• Year of publication: 2024
• a: 7.6256 ± 0.0006 Å
• b: 28.525 ± 0.002 Å
• c: 14.6246 ± 0.0011 Å
• α: 90°
• β: 102.751 ± 0.004°
• γ: 90°
• Cell volume: 3102.7 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0454
• Residual factor for significantly intense reflections: 0.0411
• Weighted residual factors for significantly intense reflections: 0.0987
• Weighted residual factors for all reflections included in the refinement: 0.1013
• Goodness-of-fit parameter for all reflections included in the refinement: 1.052
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No