Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "607bc0faa2f5328871a608dc343317db",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 181.85,
"b": 105.79,
"c": 39.57,
"alpha": 90.00,
"beta": 94.46,
"gamma": 90.00
},
"wavelengths": [0.95400],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [37.250,1.980],
"number_observations": 336413,
"number_observations_unique": 50329,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.107
},
{
"type": "R(pim)",
"value": 0.043
},
{
"type": "I/SigI",
"value": 9.600
},
{
"type": "Completeness",
"value": 97.100
},
{
"type": "Redundancy",
"value": 6.700
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [2.030,1.980],
"number_observations": 18392,
"number_observations_unique": 3241,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.694
},
{
"type": "R(pim)",
"value": 0.304
},
{
"type": "I/SigI",
"value": 2.100
},
{
"type": "Completeness",
"value": 90.500
},
{
"type": "Redundancy",
"value": 5.700
},
{
"type": "CC(1/2)",
"value": 0.769
}
]
},
{
"resolution_limits": [37.250,9.080],
"number_observations": 3487,
"number_observations_unique": 551,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.057
},
{
"type": "R(pim)",
"value": 0.024
},
{
"type": "I/SigI",
"value": 22.100
},
{
"type": "Completeness",
"value": 96.900
},
{
"type": "Redundancy",
"value": 6.300
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
}
]
}