Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e1524cb7fbbbf848c42807cb2732380c",
"space_group_name": "I 2 2 2",
"unit_cell": {
"a": 56.411,
"b": 59.091,
"c": 72.105,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97956],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.000,1.500],
"number_observations_unique": 19406,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.057
},
{
"type": "I/SigI",
"value": 13.600
},
{
"type": "Completeness",
"value": 98.500
},
{
"type": "Redundancy",
"value": 6.500
}
]
},
"refln_shells": [
{
"resolution_limits": [1.55,1.50],
"number_observations_unique": 1881,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.451
},
{
"type": "Completeness",
"value": 96.40
},
{
"type": "Redundancy",
"value": 5.70
}
]
},
{
"resolution_limits": [1.62,1.55],
"number_observations_unique": 1898,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.353
},
{
"type": "Completeness",
"value": 98.40
},
{
"type": "Redundancy",
"value": 6.40
}
]
},
{
"resolution_limits": [1.69,1.62],
"number_observations_unique": 1926,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.284
},
{
"type": "Completeness",
"value": 99.20
},
{
"type": "Redundancy",
"value": 6.60
}
]
},
{
"resolution_limits": [1.78,1.69],
"number_observations_unique": 1926,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.220
},
{
"type": "Completeness",
"value": 98.90
},
{
"type": "Redundancy",
"value": 6.80
}
]
},
{
"resolution_limits": [1.89,1.78],
"number_observations_unique": 1927,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.184
},
{
"type": "Completeness",
"value": 99.40
},
{
"type": "Redundancy",
"value": 6.90
}
]
},
{
"resolution_limits": [2.04,1.89],
"number_observations_unique": 1959,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.142
},
{
"type": "Completeness",
"value": 99.50
},
{
"type": "Redundancy",
"value": 7.00
}
]
},
{
"resolution_limits": [2.24,2.04],
"number_observations_unique": 1956,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.089
},
{
"type": "Completeness",
"value": 99.60
},
{
"type": "Redundancy",
"value": 6.70
}
]
},
{
"resolution_limits": [2.56,2.24],
"number_observations_unique": 1966,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.076
},
{
"type": "Completeness",
"value": 99.50
},
{
"type": "Redundancy",
"value": 6.70
}
]
},
{
"resolution_limits": [3.23,2.56],
"number_observations_unique": 1990,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.048
},
{
"type": "Completeness",
"value": 99.90
},
{
"type": "Redundancy",
"value": 6.60
}
]
},
{
"resolution_limits": [50.00,3.23],
"number_observations_unique": 1977,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.042
},
{
"type": "Completeness",
"value": 94.50
},
{
"type": "Redundancy",
"value": 6.00
}
]
}
]
}