Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "03b7941e560b4e1186098a2fb39e5e8b",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 118.447,
"b": 77.951,
"c": 97.881,
"alpha": 90.00,
"beta": 115.76,
"gamma": 90.00
},
"wavelengths": [1.10000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.000,1.900],
"number_observations_unique": 62779,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.063
},
{
"type": "Completeness",
"value": 98.800
},
{
"type": "Redundancy",
"value": 3.800
}
]
},
"refln_shells": [
{
"resolution_limits": [1.97,1.90],
"number_observations_unique": 6185,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.374
},
{
"type": "Completeness",
"value": 97.80
},
{
"type": "Redundancy",
"value": 3.70
}
]
},
{
"resolution_limits": [2.05,1.97],
"number_observations_unique": 6196,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.287
},
{
"type": "Completeness",
"value": 98.10
},
{
"type": "Redundancy",
"value": 3.80
}
]
},
{
"resolution_limits": [2.14,2.05],
"number_observations_unique": 6201,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.191
},
{
"type": "Completeness",
"value": 98.30
},
{
"type": "Redundancy",
"value": 3.80
}
]
},
{
"resolution_limits": [2.25,2.14],
"number_observations_unique": 6203,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.207
},
{
"type": "Completeness",
"value": 98.50
},
{
"type": "Redundancy",
"value": 3.80
}
]
},
{
"resolution_limits": [2.39,2.25],
"number_observations_unique": 6270,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.171
},
{
"type": "Completeness",
"value": 98.80
},
{
"type": "Redundancy",
"value": 3.80
}
]
},
{
"resolution_limits": [2.58,2.39],
"number_observations_unique": 6265,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.093
},
{
"type": "Completeness",
"value": 99.00
},
{
"type": "Redundancy",
"value": 3.80
}
]
},
{
"resolution_limits": [2.84,2.58],
"number_observations_unique": 6324,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.072
},
{
"type": "Completeness",
"value": 99.30
},
{
"type": "Redundancy",
"value": 3.80
}
]
},
{
"resolution_limits": [3.25,2.84],
"number_observations_unique": 6326,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.049
},
{
"type": "Completeness",
"value": 99.40
},
{
"type": "Redundancy",
"value": 3.80
}
]
},
{
"resolution_limits": [4.09,3.25],
"number_observations_unique": 6350,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.039
},
{
"type": "Completeness",
"value": 99.70
},
{
"type": "Redundancy",
"value": 3.70
}
]
},
{
"resolution_limits": [50.00,4.09],
"number_observations_unique": 6459,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.032
},
{
"type": "Completeness",
"value": 99.60
},
{
"type": "Redundancy",
"value": 3.70
}
]
}
]
}