Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "7c8211fc47b9a3df6980063558a6067e",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 91.489,
"b": 97.406,
"c": 195.653,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97910,0.97949],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.000,3.500],
"number_observations_unique": 20487,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.119
},
{
"type": "I/SigI",
"value": 8.900
},
{
"type": "Completeness",
"value": 89.500
}
]
},
"refln_shells": [
{
"resolution_limits": [3.630,3.500],
"number_observations_unique": 1595,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.249
},
{
"type": "Completeness",
"value": 71.100
}
]
},
{
"resolution_limits": [3.770,3.630],
"number_observations_unique": 1819,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.247
},
{
"type": "Completeness",
"value": 81.400
}
]
},
{
"resolution_limits": [3.940,3.770],
"number_observations_unique": 1974,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.229
},
{
"type": "Completeness",
"value": 88.000
}
]
},
{
"resolution_limits": [4.150,3.940],
"number_observations_unique": 2026,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.184
},
{
"type": "Completeness",
"value": 88.900
}
]
},
{
"resolution_limits": [4.410,4.150],
"number_observations_unique": 2041,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.178
},
{
"type": "Completeness",
"value": 90.000
}
]
},
{
"resolution_limits": [4.750,4.410],
"number_observations_unique": 2039,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.163
},
{
"type": "Completeness",
"value": 91.000
}
]
},
{
"resolution_limits": [5.230,4.750],
"number_observations_unique": 2089,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.149
},
{
"type": "Completeness",
"value": 91.700
}
]
},
{
"resolution_limits": [5.980,5.230],
"number_observations_unique": 2213,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.149
},
{
"type": "Completeness",
"value": 95.700
}
]
},
{
"resolution_limits": [7.530,5.980],
"number_observations_unique": 2327,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.118
},
{
"type": "Completeness",
"value": 99.600
}
]
},
{
"resolution_limits": [50.000,7.530],
"number_observations_unique": 2364,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.091
},
{
"type": "Completeness",
"value": 95.900
}
]
}
]
}