Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "1189d9018ac8a3172a0b257cc0bdf757",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 50.256,
"b": 54.361,
"c": 162.014,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.11600],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.00,2.889],
"number_observations_unique": 10022,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.114
},
{
"type": "I/SigI",
"value": 15
},
{
"type": "Completeness",
"value": 95.1
},
{
"type": "Redundancy",
"value": 5.9
}
]
},
"refln_shells": [
{
"resolution_limits": [3.00,2.889],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.787
},
{
"type": "I/SigI",
"value": 1.95
},
{
"type": "Completeness",
"value": 93.7
},
{
"type": "Redundancy",
"value": 4.8
}
]
},
{
"resolution_limits": [3.12,3.00],
"quality_factors": [
{
"type": "Completeness",
"value": 95.9
}
]
},
{
"resolution_limits": [3.27,3.12],
"quality_factors": [
{
"type": "Completeness",
"value": 94.9
}
]
},
{
"resolution_limits": [3.44,3.27],
"quality_factors": [
{
"type": "Completeness",
"value": 94.6
}
]
},
{
"resolution_limits": [3.65,3.44],
"quality_factors": [
{
"type": "Completeness",
"value": 94.4
}
]
},
{
"resolution_limits": [3.94,3.65],
"quality_factors": [
{
"type": "Completeness",
"value": 94.7
}
]
},
{
"resolution_limits": [4.33,3.94],
"quality_factors": [
{
"type": "Completeness",
"value": 94.3
}
]
},
{
"resolution_limits": [4.96,4.33],
"quality_factors": [
{
"type": "Completeness",
"value": 92.1
}
]
},
{
"resolution_limits": [6.24,4.96],
"quality_factors": [
{
"type": "Completeness",
"value": 96.0
}
]
},
{
"resolution_limits": [50.00,6.24],
"quality_factors": [
{
"type": "Completeness",
"value": 99.7
}
]
}
]
}