Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "4575f16b3390790f694a0a8e8378652b",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 65.055,
"b": 184.265,
"c": 71.545,
"alpha": 90.0,
"beta": 106.1,
"gamma": 90.0
},
"wavelengths": [0.97630],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [62.500,1.5390],
"number_observations_unique": 218441,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.073
},
{
"type": "R(meas)",
"value": 0.081
},
{
"type": "R(pim)",
"value": 0.035
},
{
"type": "I/SigI",
"value": 9.400
},
{
"type": "Completeness",
"value": 91.700
},
{
"type": "Redundancy",
"value": 4.900
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.620,1.540],
"number_observations": 75420,
"number_observations_unique": 20903,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.967
},
{
"type": "R(meas)",
"value": 1.124
},
{
"type": "R(pim)",
"value": 0.559
},
{
"type": "I/SigI",
"value": 1.100
},
{
"type": "Completeness",
"value": 60.200
},
{
"type": "Redundancy",
"value": 3.600
},
{
"type": "CC(1/2)",
"value": 0.438
}
]
},
{
"resolution_limits": [62.500,4.870],
"number_observations": 38138,
"number_observations_unique": 7618,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.046
},
{
"type": "R(meas)",
"value": 0.051
},
{
"type": "R(pim)",
"value": 0.022
},
{
"type": "I/SigI",
"value": 20.000
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 5.000
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}