Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "cb9bdf6271cd65643bd3581f5d3f96a7",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 51.870,
"b": 56.918,
"c": 114.960,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [56.880,1.580],
"number_observations": 302074,
"number_observations_unique": 47472,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.132
},
{
"type": "R(meas)",
"value": 0.144
},
{
"type": "R(pim)",
"value": 0.057
},
{
"type": "I/SigI",
"value": 6.000
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 6.400
},
{
"type": "CC(1/2)",
"value": 0.990
}
]
},
"refln_shells": [
{
"resolution_limits": [1.620,1.580],
"number_observations": 22730,
"number_observations_unique": 3460,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.618
},
{
"type": "R(meas)",
"value": 1.756
},
{
"type": "R(pim)",
"value": 0.677
},
{
"type": "I/SigI",
"value": 1.200
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 6.600
},
{
"type": "CC(1/2)",
"value": 0.525
}
]
},
{
"resolution_limits": [56.880,7.070],
"number_observations": 3844,
"number_observations_unique": 626,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.100
},
{
"type": "R(meas)",
"value": 0.110
},
{
"type": "R(pim)",
"value": 0.045
},
{
"type": "I/SigI",
"value": 16.200
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.100
},
{
"type": "CC(1/2)",
"value": 0.972
}
]
}
]
}