Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "87a6f6fd8397c4b73f131ab873b3064a",
"space_group_name": "I 4",
"unit_cell": {
"a": 95.436,
"b": 95.436,
"c": 45.898,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92134],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [41.360,1.340],
"number_observations": 547453,
"number_observations_unique": 45816,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.122
},
{
"type": "R(meas)",
"value": 0.127
},
{
"type": "R(pim)",
"value": 0.035
},
{
"type": "I/SigI",
"value": 9.800
},
{
"type": "Completeness",
"value": 98.700
},
{
"type": "Redundancy",
"value": 11.900
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.360,1.340],
"number_observations": 12521,
"number_observations_unique": 2054,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.635
},
{
"type": "R(meas)",
"value": 1.806
},
{
"type": "R(pim)",
"value": 0.726
},
{
"type": "I/SigI",
"value": 0.500
},
{
"type": "Completeness",
"value": 88.000
},
{
"type": "Redundancy",
"value": 6.100
},
{
"type": "CC(1/2)",
"value": 0.277
}
]
},
{
"resolution_limits": [41.360,7.220],
"number_observations": 3968,
"number_observations_unique": 326,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.066
},
{
"type": "R(meas)",
"value": 0.069
},
{
"type": "R(pim)",
"value": 0.021
},
{
"type": "I/SigI",
"value": 47.300
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 12.200
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
}
]
}