Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "1a259da51709ad073ad6a17f06155499",
"space_group_name": "P 43 21 2",
"unit_cell": {
"a": 70.984,
"b": 70.984,
"c": 196.031,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92124],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [35.480,1.910],
"number_observations": 1062492,
"number_observations_unique": 39939,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.328
},
{
"type": "R(meas)",
"value": 0.334
},
{
"type": "R(pim)",
"value": 0.064
},
{
"type": "I/SigI",
"value": 6.700
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 26.600
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.960,1.910],
"number_observations": 73005,
"number_observations_unique": 2609,
"quality_factors": [
{
"type": "R(merge)",
"value": 7.120
},
{
"type": "R(meas)",
"value": 7.250
},
{
"type": "R(pim)",
"value": 1.353
},
{
"type": "I/SigI",
"value": 0.400
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 28.000
},
{
"type": "CC(1/2)",
"value": 0.393
}
]
},
{
"resolution_limits": [35.480,8.960],
"number_observations": 9445,
"number_observations_unique": 482,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.056
},
{
"type": "R(meas)",
"value": 0.058
},
{
"type": "R(pim)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 38.600
},
{
"type": "Completeness",
"value": 98.900
},
{
"type": "Redundancy",
"value": 19.600
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}