Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "80c8f12a93a6f4df6839689a2c2e51b6",
"space_group_name": "H 3 2",
"unit_cell": {
"a": 143.84,
"b": 143.84,
"c": 204.25,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [1.54180],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [19.19,2.000],
"number_observations_unique": 54795,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.074
},
{
"type": "I/SigI",
"value": 17.890
},
{
"type": "Completeness",
"value": 99.100
}
]
},
"refln_shells": [
{
"resolution_limits": [2.10,2.00],
"number_observations": 38164,
"number_observations_unique": 7295,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.421
},
{
"type": "I/SigI",
"value": 4.3
},
{
"type": "Completeness",
"value": 98.60
}
]
},
{
"resolution_limits": [2.20,2.10],
"number_observations": 32649,
"number_observations_unique": 6052,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.324
},
{
"type": "I/SigI",
"value": 5.6
},
{
"type": "Completeness",
"value": 99.00
}
]
},
{
"resolution_limits": [2.30,2.20],
"number_observations": 27854,
"number_observations_unique": 5054,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.253
},
{
"type": "I/SigI",
"value": 7.1
},
{
"type": "Completeness",
"value": 98.90
}
]
},
{
"resolution_limits": [2.40,2.30],
"number_observations": 24052,
"number_observations_unique": 4283,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.213
},
{
"type": "I/SigI",
"value": 8.5
},
{
"type": "Completeness",
"value": 99.00
}
]
},
{
"resolution_limits": [2.50,2.40],
"number_observations": 20340,
"number_observations_unique": 3610,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.178
},
{
"type": "I/SigI",
"value": 10.0
},
{
"type": "Completeness",
"value": 99.20
}
]
},
{
"resolution_limits": [2.60,2.50],
"number_observations": 17457,
"number_observations_unique": 3072,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.152
},
{
"type": "I/SigI",
"value": 11.4
},
{
"type": "Completeness",
"value": 99.30
}
]
},
{
"resolution_limits": [2.80,2.60],
"number_observations": 28176,
"number_observations_unique": 4941,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.117
},
{
"type": "I/SigI",
"value": 14.5
},
{
"type": "Completeness",
"value": 99.40
}
]
},
{
"resolution_limits": [3.00,2.80],
"number_observations": 21319,
"number_observations_unique": 3725,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.085
},
{
"type": "I/SigI",
"value": 18.9
},
{
"type": "Completeness",
"value": 99.50
}
]
},
{
"resolution_limits": [3.50,3.00],
"number_observations": 34563,
"number_observations_unique": 6017,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.055
},
{
"type": "I/SigI",
"value": 26.9
},
{
"type": "Completeness",
"value": 99.80
}
]
},
{
"resolution_limits": [4.00,3.50],
"number_observations": 19685,
"number_observations_unique": 3413,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.039
},
{
"type": "I/SigI",
"value": 35.9
},
{
"type": "Completeness",
"value": 99.80
}
]
},
{
"resolution_limits": [5.00,4.00],
"number_observations": 19547,
"number_observations_unique": 3390,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.031
},
{
"type": "I/SigI",
"value": 44.3
},
{
"type": "Completeness",
"value": 99.90
}
]
},
{
"resolution_limits": [6.00,5.00],
"number_observations": 8753,
"number_observations_unique": 1518,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.03
},
{
"type": "I/SigI",
"value": 46.0
},
{
"type": "Completeness",
"value": 99.90
}
]
},
{
"resolution_limits": [19.19,6.00],
"number_observations": 9444,
"number_observations_unique": 1665,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.021
},
{
"type": "I/SigI",
"value": 55.6
},
{
"type": "Completeness",
"value": 99.60
}
]
}
]
}