Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "8eb1523121ca08ace95c11521fad82c9",
"space_group_name": "P 43 21 2",
"unit_cell": {
"a": 52.501,
"b": 52.501,
"c": 80.217,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.00900],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.00,1.82],
"number_observations_unique": 10567,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.055
},
{
"type": "Completeness",
"value": 99.400
}
]
},
"refln_shells": [
{
"resolution_limits": [1.89,1.82],
"number_observations": 978,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.231
},
{
"type": "Completeness",
"value": 95.000
}
]
},
{
"resolution_limits": [1.96,1.89],
"number_observations": 1027,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.205
},
{
"type": "Completeness",
"value": 99.300
}
]
},
{
"resolution_limits": [2.05,1.96],
"number_observations": 1026,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.136
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [2.16,2.05],
"number_observations": 1041,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.091
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [2.29,2.16],
"number_observations": 1047,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.076
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [2.47,2.29],
"number_observations": 1045,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.068
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [2.72,2.47],
"number_observations": 1055,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.062
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [3.11,2.72],
"number_observations": 1077,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.051
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [3.92,3.11],
"number_observations": 1089,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.045
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [50.00,3.92],
"number_observations": 1182,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.039
},
{
"type": "Completeness",
"value": 99.700
}
]
}
]
}