Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b70e99f6d67864adb27f6bd1122702cc",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 54.88,
"b": 104.75,
"c": 153.75,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.71080],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [51.690,2.300],
"number_observations_unique": 39464,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.113
},
{
"type": "I/SigI",
"value": 13.700
},
{
"type": "Completeness",
"value": 98.200
},
{
"type": "Redundancy",
"value": 6.900
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [2.380,2.300],
"number_observations_unique": 3750,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.446
},
{
"type": "Completeness",
"value": 96.800
},
{
"type": "Redundancy",
"value": 6.300
},
{
"type": "CC(1/2)",
"value": 0.939
}
]
},
{
"resolution_limits": [51.690,8.910],
"number_observations_unique": 796,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.048
},
{
"type": "Completeness",
"value": 99.300
},
{
"type": "Redundancy",
"value": 6.100
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
}
]
}